USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1106 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 THR OG1 : rot 106:sc= 0.708 USER MOD Set 1.2: A 31 HIS : no HE2:sc= 0.232 K(o=1.4,f=-0.5) USER MOD Set 1.3: A 128 THR OG1 : rot -89:sc= 0.44 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 49:sc= 0.542 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -154:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.13) USER MOD Single : A 14 GLN : amide:sc= -3.58 X(o=-3.6,f=-3.5) USER MOD Single : A 19 HIS : no HD1:sc= -1.02 K(o=-1,f=-7.1!) USER MOD Single : A 20 SER OG : rot 160:sc= -0.485 USER MOD Single : A 21 SER OG : rot 180:sc= -0.303 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -4.9! C(o=-4.9!,f=-6.4!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot -160:sc= -0.041 USER MOD Single : A 35 ASN : amide:sc= -0.778 K(o=-0.78,f=-0.099) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 160:sc= -1.93 USER MOD Single : A 47 TYR OH : rot 180:sc= -0.0342 USER MOD Single : A 50 MET CE :methyl -135:sc= -2.88 (180deg=-3.96!) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.882 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 154:sc= 0.265 USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot -39:sc= -3.52! USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.378 K(o=-0.38,f=-5.6!) USER MOD Single : A 77 GLN : amide:sc= -1.27 K(o=-1.3,f=-2.6!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 47:sc= 0.505 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -2.74! C(o=-2.7!,f=-4!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 155:sc= -0.15 (180deg=-0.753) USER MOD Single : A 99 ASN : amide:sc= -0.965 K(o=-0.97,f=-6.5!) USER MOD Single : A 100 SER OG : rot 150:sc= -0.631 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 158:sc= 1.28 (180deg=1.22) USER MOD Single : A 113 LYS NZ :NH3+ -169:sc=-0.000188 (180deg=-0.309) USER MOD Single : A 120 SER OG : rot 55:sc= -0.24 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -1.59 K(o=-1.6,f=-0.26) USER MOD Single : A 131 TYR OH : rot 180:sc= 0.488 USER MOD Single : A 134 THR OG1 : rot -27:sc= 0.214 USER MOD Single : A 137 SER OG : rot 16:sc= 0.433! USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 28.448 8.926 10.613 1.00 0.00 N ATOM 2 CA GLY A 1 28.870 10.140 11.287 1.00 0.00 C ATOM 3 C GLY A 1 27.986 11.325 10.954 1.00 0.00 C ATOM 4 O GLY A 1 27.048 11.636 11.688 1.00 0.00 O ATOM 0 H1 GLY A 1 29.084 8.145 10.873 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.476 8.691 10.898 1.00 0.00 H new ATOM 0 H3 GLY A 1 28.481 9.071 9.584 1.00 0.00 H new ATOM 0 HA2 GLY A 1 28.861 9.976 12.364 1.00 0.00 H new ATOM 0 HA3 GLY A 1 29.899 10.368 11.008 1.00 0.00 H new ATOM 8 N SER A 2 28.287 11.991 9.843 1.00 0.00 N ATOM 9 CA SER A 2 27.517 13.153 9.416 1.00 0.00 C ATOM 10 C SER A 2 26.021 12.856 9.450 1.00 0.00 C ATOM 11 O SER A 2 25.608 11.718 9.678 1.00 0.00 O ATOM 12 CB SER A 2 27.932 13.577 8.006 1.00 0.00 C ATOM 13 OG SER A 2 29.199 14.212 8.017 1.00 0.00 O ATOM 0 H SER A 2 29.059 11.745 9.223 1.00 0.00 H new ATOM 0 HA SER A 2 27.724 13.969 10.109 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.965 12.703 7.355 1.00 0.00 H new ATOM 0 HB3 SER A 2 27.185 14.255 7.592 1.00 0.00 H new ATOM 0 HG SER A 2 29.443 14.472 7.104 1.00 0.00 H new ATOM 19 N SER A 3 25.213 13.886 9.222 1.00 0.00 N ATOM 20 CA SER A 3 23.763 13.737 9.230 1.00 0.00 C ATOM 21 C SER A 3 23.226 13.573 7.811 1.00 0.00 C ATOM 22 O SER A 3 23.504 14.387 6.932 1.00 0.00 O ATOM 23 CB SER A 3 23.108 14.948 9.898 1.00 0.00 C ATOM 24 OG SER A 3 23.587 15.121 11.221 1.00 0.00 O ATOM 0 H SER A 3 25.538 14.833 9.029 1.00 0.00 H new ATOM 0 HA SER A 3 23.518 12.840 9.799 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.313 15.845 9.313 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.026 14.818 9.914 1.00 0.00 H new ATOM 0 HG SER A 3 23.155 15.902 11.626 1.00 0.00 H new ATOM 30 N GLY A 4 22.453 12.513 7.597 1.00 0.00 N ATOM 31 CA GLY A 4 21.888 12.259 6.284 1.00 0.00 C ATOM 32 C GLY A 4 20.377 12.380 6.269 1.00 0.00 C ATOM 33 O GLY A 4 19.667 11.381 6.385 1.00 0.00 O ATOM 0 H GLY A 4 22.208 11.825 8.309 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.313 12.962 5.567 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.172 11.259 5.957 1.00 0.00 H new ATOM 37 N SER A 5 19.884 13.606 6.128 1.00 0.00 N ATOM 38 CA SER A 5 18.447 13.854 6.105 1.00 0.00 C ATOM 39 C SER A 5 17.825 13.320 4.818 1.00 0.00 C ATOM 40 O SER A 5 17.709 14.039 3.827 1.00 0.00 O ATOM 41 CB SER A 5 18.165 15.351 6.238 1.00 0.00 C ATOM 42 OG SER A 5 18.846 16.090 5.239 1.00 0.00 O ATOM 0 H SER A 5 20.458 14.443 6.028 1.00 0.00 H new ATOM 0 HA SER A 5 17.999 13.331 6.949 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.093 15.530 6.160 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.475 15.696 7.224 1.00 0.00 H new ATOM 0 HG SER A 5 18.688 15.679 4.363 1.00 0.00 H new ATOM 48 N SER A 6 17.426 12.052 4.843 1.00 0.00 N ATOM 49 CA SER A 6 16.819 11.419 3.678 1.00 0.00 C ATOM 50 C SER A 6 15.306 11.617 3.679 1.00 0.00 C ATOM 51 O SER A 6 14.629 11.310 4.660 1.00 0.00 O ATOM 52 CB SER A 6 17.149 9.925 3.653 1.00 0.00 C ATOM 53 OG SER A 6 17.143 9.423 2.328 1.00 0.00 O ATOM 0 H SER A 6 17.512 11.443 5.657 1.00 0.00 H new ATOM 0 HA SER A 6 17.229 11.890 2.784 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.127 9.758 4.104 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.423 9.379 4.255 1.00 0.00 H new ATOM 0 HG SER A 6 17.358 8.467 2.339 1.00 0.00 H new ATOM 59 N GLY A 7 14.782 12.132 2.571 1.00 0.00 N ATOM 60 CA GLY A 7 13.354 12.363 2.464 1.00 0.00 C ATOM 61 C GLY A 7 12.805 11.979 1.104 1.00 0.00 C ATOM 62 O GLY A 7 13.445 11.242 0.354 1.00 0.00 O ATOM 0 H GLY A 7 15.321 12.393 1.746 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.838 11.791 3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.144 13.416 2.653 1.00 0.00 H new ATOM 66 N SER A 8 11.615 12.478 0.785 1.00 0.00 N ATOM 67 CA SER A 8 10.977 12.179 -0.492 1.00 0.00 C ATOM 68 C SER A 8 10.507 13.458 -1.177 1.00 0.00 C ATOM 69 O SER A 8 9.661 14.192 -0.666 1.00 0.00 O ATOM 70 CB SER A 8 9.793 11.233 -0.285 1.00 0.00 C ATOM 71 OG SER A 8 10.228 9.889 -0.166 1.00 0.00 O ATOM 0 H SER A 8 11.073 13.091 1.394 1.00 0.00 H new ATOM 0 HA SER A 8 11.713 11.694 -1.133 1.00 0.00 H new ATOM 0 HB2 SER A 8 9.245 11.522 0.612 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.102 11.322 -1.123 1.00 0.00 H new ATOM 0 HG SER A 8 9.506 9.286 -0.440 1.00 0.00 H new ATOM 77 N PRO A 9 11.069 13.733 -2.364 1.00 0.00 N ATOM 78 CA PRO A 9 10.723 14.923 -3.147 1.00 0.00 C ATOM 79 C PRO A 9 9.312 14.849 -3.721 1.00 0.00 C ATOM 80 O PRO A 9 8.652 15.873 -3.906 1.00 0.00 O ATOM 81 CB PRO A 9 11.759 14.920 -4.273 1.00 0.00 C ATOM 82 CG PRO A 9 12.161 13.493 -4.414 1.00 0.00 C ATOM 83 CD PRO A 9 12.084 12.902 -3.034 1.00 0.00 C ATOM 0 HA PRO A 9 10.736 15.828 -2.540 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.336 15.306 -5.201 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.614 15.550 -4.026 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.498 12.967 -5.101 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.170 13.410 -4.818 1.00 0.00 H new ATOM 0 HD2 PRO A 9 11.790 11.853 -3.062 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.045 12.950 -2.522 1.00 0.00 H new ATOM 91 N LEU A 10 8.855 13.634 -4.001 1.00 0.00 N ATOM 92 CA LEU A 10 7.521 13.427 -4.553 1.00 0.00 C ATOM 93 C LEU A 10 6.509 13.149 -3.446 1.00 0.00 C ATOM 94 O LEU A 10 5.377 13.629 -3.490 1.00 0.00 O ATOM 95 CB LEU A 10 7.534 12.266 -5.550 1.00 0.00 C ATOM 96 CG LEU A 10 8.538 12.379 -6.698 1.00 0.00 C ATOM 97 CD1 LEU A 10 8.637 11.062 -7.452 1.00 0.00 C ATOM 98 CD2 LEU A 10 8.145 13.508 -7.640 1.00 0.00 C ATOM 0 H LEU A 10 9.388 12.777 -3.855 1.00 0.00 H new ATOM 0 HA LEU A 10 7.224 14.340 -5.070 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.740 11.346 -5.003 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.535 12.167 -5.975 1.00 0.00 H new ATOM 0 HG LEU A 10 9.518 12.607 -6.278 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.356 11.161 -8.265 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.966 10.277 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.660 10.803 -7.861 1.00 0.00 H new ATOM 0 HD21 LEU A 10 8.870 13.574 -8.451 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.156 13.310 -8.053 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.127 14.450 -7.092 1.00 0.00 H new ATOM 110 N GLY A 11 6.927 12.372 -2.451 1.00 0.00 N ATOM 111 CA GLY A 11 6.046 12.045 -1.345 1.00 0.00 C ATOM 112 C GLY A 11 6.199 10.608 -0.887 1.00 0.00 C ATOM 113 O GLY A 11 7.150 9.927 -1.269 1.00 0.00 O ATOM 0 H GLY A 11 7.860 11.963 -2.391 1.00 0.00 H new ATOM 0 HA2 GLY A 11 6.254 12.713 -0.509 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.012 12.220 -1.644 1.00 0.00 H new ATOM 117 N GLN A 12 5.262 10.148 -0.064 1.00 0.00 N ATOM 118 CA GLN A 12 5.299 8.784 0.448 1.00 0.00 C ATOM 119 C GLN A 12 3.891 8.211 0.572 1.00 0.00 C ATOM 120 O GLN A 12 2.902 8.928 0.415 1.00 0.00 O ATOM 121 CB GLN A 12 5.999 8.746 1.808 1.00 0.00 C ATOM 122 CG GLN A 12 7.475 9.102 1.741 1.00 0.00 C ATOM 123 CD GLN A 12 8.115 9.196 3.113 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.876 8.357 3.981 1.00 0.00 O ATOM 125 NE2 GLN A 12 8.934 10.222 3.315 1.00 0.00 N ATOM 0 H GLN A 12 4.469 10.700 0.262 1.00 0.00 H new ATOM 0 HA GLN A 12 5.860 8.173 -0.259 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.497 9.437 2.485 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.893 7.748 2.234 1.00 0.00 H new ATOM 0 HG2 GLN A 12 8.000 8.351 1.150 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.592 10.054 1.223 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.104 10.894 2.567 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.393 10.338 4.218 1.00 0.00 H new ATOM 134 N ILE A 13 3.808 6.915 0.854 1.00 0.00 N ATOM 135 CA ILE A 13 2.521 6.246 1.000 1.00 0.00 C ATOM 136 C ILE A 13 2.655 4.968 1.822 1.00 0.00 C ATOM 137 O ILE A 13 3.643 4.245 1.704 1.00 0.00 O ATOM 138 CB ILE A 13 1.908 5.900 -0.370 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.488 5.357 -0.196 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.781 4.891 -1.101 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.263 5.200 -1.499 1.00 0.00 C ATOM 0 H ILE A 13 4.617 6.307 0.986 1.00 0.00 H new ATOM 0 HA ILE A 13 1.861 6.941 1.519 1.00 0.00 H new ATOM 0 HB ILE A 13 1.858 6.809 -0.969 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.536 4.390 0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.071 6.027 0.458 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.335 4.656 -2.067 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.775 5.312 -1.253 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.860 3.980 -0.507 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.261 4.811 -1.299 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.343 6.169 -1.992 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.273 4.507 -2.147 1.00 0.00 H new ATOM 153 N GLN A 14 1.653 4.697 2.652 1.00 0.00 N ATOM 154 CA GLN A 14 1.659 3.506 3.492 1.00 0.00 C ATOM 155 C GLN A 14 0.580 2.522 3.050 1.00 0.00 C ATOM 156 O GLN A 14 -0.612 2.823 3.114 1.00 0.00 O ATOM 157 CB GLN A 14 1.446 3.889 4.958 1.00 0.00 C ATOM 158 CG GLN A 14 2.016 2.878 5.940 1.00 0.00 C ATOM 159 CD GLN A 14 1.994 3.377 7.371 1.00 0.00 C ATOM 160 OE1 GLN A 14 1.095 4.120 7.768 1.00 0.00 O ATOM 161 NE2 GLN A 14 2.986 2.972 8.155 1.00 0.00 N ATOM 0 H GLN A 14 0.827 5.286 2.760 1.00 0.00 H new ATOM 0 HA GLN A 14 2.631 3.023 3.387 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.905 4.860 5.142 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.378 4.001 5.144 1.00 0.00 H new ATOM 0 HG2 GLN A 14 1.446 1.952 5.874 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.042 2.642 5.658 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.710 2.356 7.785 1.00 0.00 H new ATOM 0 HE22 GLN A 14 3.024 3.276 9.128 1.00 0.00 H new ATOM 170 N LEU A 15 1.007 1.347 2.601 1.00 0.00 N ATOM 171 CA LEU A 15 0.078 0.318 2.148 1.00 0.00 C ATOM 172 C LEU A 15 0.376 -1.019 2.818 1.00 0.00 C ATOM 173 O LEU A 15 1.507 -1.505 2.785 1.00 0.00 O ATOM 174 CB LEU A 15 0.155 0.168 0.627 1.00 0.00 C ATOM 175 CG LEU A 15 -0.061 1.445 -0.186 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.647 1.349 -1.528 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.547 1.707 -0.382 1.00 0.00 C ATOM 0 H LEU A 15 1.990 1.083 2.541 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.930 0.625 2.427 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.133 -0.240 0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.588 -0.566 0.316 1.00 0.00 H new ATOM 0 HG LEU A 15 0.365 2.282 0.367 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.482 2.267 -2.093 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.716 1.209 -1.366 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.251 0.502 -2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.682 2.620 -0.963 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.997 0.869 -0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.028 1.821 0.590 1.00 0.00 H new ATOM 189 N THR A 16 -0.648 -1.612 3.426 1.00 0.00 N ATOM 190 CA THR A 16 -0.496 -2.893 4.104 1.00 0.00 C ATOM 191 C THR A 16 -0.818 -4.052 3.167 1.00 0.00 C ATOM 192 O THR A 16 -1.983 -4.321 2.874 1.00 0.00 O ATOM 193 CB THR A 16 -1.404 -2.983 5.344 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.113 -1.909 6.244 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.216 -4.314 6.057 1.00 0.00 C ATOM 0 H THR A 16 -1.591 -1.225 3.462 1.00 0.00 H new ATOM 0 HA THR A 16 0.545 -2.963 4.419 1.00 0.00 H new ATOM 0 HB THR A 16 -2.440 -2.909 5.014 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.832 -1.245 6.204 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.868 -4.354 6.930 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.467 -5.129 5.378 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.178 -4.413 6.374 1.00 0.00 H new ATOM 203 N ILE A 17 0.222 -4.735 2.699 1.00 0.00 N ATOM 204 CA ILE A 17 0.049 -5.866 1.797 1.00 0.00 C ATOM 205 C ILE A 17 0.088 -7.187 2.557 1.00 0.00 C ATOM 206 O ILE A 17 1.054 -7.482 3.261 1.00 0.00 O ATOM 207 CB ILE A 17 1.133 -5.884 0.703 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.131 -4.563 -0.069 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.912 -7.056 -0.242 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.156 -4.512 -1.181 1.00 0.00 C ATOM 0 H ILE A 17 1.193 -4.524 2.930 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.928 -5.749 1.328 1.00 0.00 H new ATOM 0 HB ILE A 17 2.106 -6.004 1.178 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.140 -4.400 -0.492 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.320 -3.745 0.626 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.686 -7.055 -1.010 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.958 -7.989 0.319 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.067 -6.964 -0.713 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.098 -3.547 -1.685 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.154 -4.643 -0.762 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.955 -5.309 -1.898 1.00 0.00 H new ATOM 222 N ARG A 18 -0.969 -7.980 2.410 1.00 0.00 N ATOM 223 CA ARG A 18 -1.055 -9.270 3.083 1.00 0.00 C ATOM 224 C ARG A 18 -1.895 -10.252 2.270 1.00 0.00 C ATOM 225 O ARG A 18 -3.119 -10.134 2.207 1.00 0.00 O ATOM 226 CB ARG A 18 -1.657 -9.102 4.479 1.00 0.00 C ATOM 227 CG ARG A 18 -1.856 -10.415 5.218 1.00 0.00 C ATOM 228 CD ARG A 18 -2.790 -10.249 6.407 1.00 0.00 C ATOM 229 NE ARG A 18 -3.459 -11.499 6.757 1.00 0.00 N ATOM 230 CZ ARG A 18 -4.568 -11.929 6.165 1.00 0.00 C ATOM 231 NH1 ARG A 18 -5.129 -11.214 5.200 1.00 0.00 N ATOM 232 NH2 ARG A 18 -5.118 -13.078 6.539 1.00 0.00 N ATOM 0 H ARG A 18 -1.777 -7.751 1.831 1.00 0.00 H new ATOM 0 HA ARG A 18 -0.046 -9.671 3.176 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -1.007 -8.457 5.070 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.618 -8.594 4.393 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -2.264 -11.160 4.535 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.892 -10.791 5.561 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -2.223 -9.889 7.265 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -3.538 -9.490 6.177 1.00 0.00 H new ATOM 0 HE ARG A 18 -3.053 -12.073 7.496 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.709 -10.331 4.910 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -5.980 -11.547 4.748 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -4.689 -13.631 7.281 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -5.969 -13.408 6.084 1.00 0.00 H new ATOM 246 N HIS A 19 -1.229 -11.220 1.649 1.00 0.00 N ATOM 247 CA HIS A 19 -1.914 -12.222 0.840 1.00 0.00 C ATOM 248 C HIS A 19 -2.096 -13.519 1.622 1.00 0.00 C ATOM 249 O HIS A 19 -1.129 -14.100 2.114 1.00 0.00 O ATOM 250 CB HIS A 19 -1.131 -12.493 -0.445 1.00 0.00 C ATOM 251 CG HIS A 19 -1.737 -13.562 -1.301 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.805 -14.885 -0.918 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.306 -13.498 -2.528 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.388 -15.588 -1.872 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.702 -14.770 -2.860 1.00 0.00 N ATOM 0 H HIS A 19 -0.216 -11.332 1.690 1.00 0.00 H new ATOM 0 HA HIS A 19 -2.899 -11.833 0.581 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.065 -11.571 -1.022 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.112 -12.780 -0.186 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.426 -12.611 -3.133 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.576 -16.651 -1.848 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.164 -15.039 -3.729 1.00 0.00 H new ATOM 263 N SER A 20 -3.343 -13.967 1.733 1.00 0.00 N ATOM 264 CA SER A 20 -3.653 -15.193 2.459 1.00 0.00 C ATOM 265 C SER A 20 -3.683 -16.391 1.514 1.00 0.00 C ATOM 266 O SER A 20 -4.246 -16.321 0.422 1.00 0.00 O ATOM 267 CB SER A 20 -4.998 -15.061 3.175 1.00 0.00 C ATOM 268 OG SER A 20 -5.518 -16.332 3.523 1.00 0.00 O ATOM 0 H SER A 20 -4.155 -13.499 1.329 1.00 0.00 H new ATOM 0 HA SER A 20 -2.870 -15.355 3.199 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.877 -14.456 4.073 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.706 -14.539 2.532 1.00 0.00 H new ATOM 0 HG SER A 20 -6.183 -16.229 4.236 1.00 0.00 H new ATOM 274 N SER A 21 -3.072 -17.491 1.944 1.00 0.00 N ATOM 275 CA SER A 21 -3.024 -18.704 1.136 1.00 0.00 C ATOM 276 C SER A 21 -4.378 -19.407 1.132 1.00 0.00 C ATOM 277 O SER A 21 -4.942 -19.684 0.074 1.00 0.00 O ATOM 278 CB SER A 21 -1.946 -19.652 1.664 1.00 0.00 C ATOM 279 OG SER A 21 -2.290 -20.154 2.944 1.00 0.00 O ATOM 0 H SER A 21 -2.604 -17.567 2.847 1.00 0.00 H new ATOM 0 HA SER A 21 -2.778 -18.420 0.113 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.814 -20.481 0.968 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.992 -19.128 1.720 1.00 0.00 H new ATOM 0 HG SER A 21 -1.586 -20.759 3.258 1.00 0.00 H new ATOM 285 N GLN A 22 -4.892 -19.694 2.324 1.00 0.00 N ATOM 286 CA GLN A 22 -6.180 -20.365 2.458 1.00 0.00 C ATOM 287 C GLN A 22 -7.278 -19.585 1.744 1.00 0.00 C ATOM 288 O GLN A 22 -8.119 -20.166 1.057 1.00 0.00 O ATOM 289 CB GLN A 22 -6.537 -20.536 3.936 1.00 0.00 C ATOM 290 CG GLN A 22 -5.591 -21.457 4.689 1.00 0.00 C ATOM 291 CD GLN A 22 -5.847 -21.462 6.183 1.00 0.00 C ATOM 292 OE1 GLN A 22 -6.526 -22.347 6.705 1.00 0.00 O ATOM 293 NE2 GLN A 22 -5.304 -20.472 6.880 1.00 0.00 N ATOM 0 H GLN A 22 -4.437 -19.473 3.210 1.00 0.00 H new ATOM 0 HA GLN A 22 -6.099 -21.348 1.994 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -6.537 -19.558 4.416 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -7.551 -20.929 4.013 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -5.694 -22.471 4.303 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -4.563 -21.147 4.502 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -4.748 -19.760 6.406 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -5.442 -20.423 7.889 1.00 0.00 H new ATOM 302 N ARG A 23 -7.265 -18.267 1.911 1.00 0.00 N ATOM 303 CA ARG A 23 -8.262 -17.408 1.283 1.00 0.00 C ATOM 304 C ARG A 23 -7.847 -17.044 -0.140 1.00 0.00 C ATOM 305 O ARG A 23 -8.672 -16.625 -0.950 1.00 0.00 O ATOM 306 CB ARG A 23 -8.462 -16.135 2.108 1.00 0.00 C ATOM 307 CG ARG A 23 -9.534 -16.265 3.177 1.00 0.00 C ATOM 308 CD ARG A 23 -10.071 -14.905 3.596 1.00 0.00 C ATOM 309 NE ARG A 23 -10.920 -14.993 4.781 1.00 0.00 N ATOM 310 CZ ARG A 23 -12.171 -15.442 4.757 1.00 0.00 C ATOM 311 NH1 ARG A 23 -12.714 -15.841 3.616 1.00 0.00 N ATOM 312 NH2 ARG A 23 -12.880 -15.492 5.878 1.00 0.00 N ATOM 0 H ARG A 23 -6.576 -17.771 2.476 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.203 -17.957 1.240 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -7.518 -15.868 2.583 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -8.725 -15.316 1.439 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.352 -16.880 2.801 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -9.122 -16.778 4.046 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.237 -14.232 3.797 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -10.640 -14.471 2.774 1.00 0.00 H new ATOM 0 HE ARG A 23 -10.532 -14.694 5.676 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -12.172 -15.804 2.753 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -13.674 -16.185 3.601 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.465 -15.186 6.758 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -13.840 -15.837 5.859 1.00 0.00 H new ATOM 326 N ASN A 24 -6.561 -17.207 -0.436 1.00 0.00 N ATOM 327 CA ASN A 24 -6.036 -16.894 -1.760 1.00 0.00 C ATOM 328 C ASN A 24 -6.549 -15.541 -2.243 1.00 0.00 C ATOM 329 O ASN A 24 -6.892 -15.376 -3.414 1.00 0.00 O ATOM 330 CB ASN A 24 -6.428 -17.987 -2.758 1.00 0.00 C ATOM 331 CG ASN A 24 -7.928 -18.199 -2.822 1.00 0.00 C ATOM 332 OD1 ASN A 24 -8.511 -18.856 -1.958 1.00 0.00 O ATOM 333 ND2 ASN A 24 -8.561 -17.644 -3.849 1.00 0.00 N ATOM 0 H ASN A 24 -5.864 -17.554 0.223 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.949 -16.847 -1.691 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -6.059 -17.721 -3.748 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.943 -18.922 -2.478 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -9.570 -17.754 -3.946 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.038 -17.108 -4.541 1.00 0.00 H new ATOM 340 N LYS A 25 -6.598 -14.574 -1.334 1.00 0.00 N ATOM 341 CA LYS A 25 -7.066 -13.234 -1.665 1.00 0.00 C ATOM 342 C LYS A 25 -6.013 -12.187 -1.315 1.00 0.00 C ATOM 343 O LYS A 25 -5.330 -12.296 -0.296 1.00 0.00 O ATOM 344 CB LYS A 25 -8.370 -12.929 -0.924 1.00 0.00 C ATOM 345 CG LYS A 25 -9.559 -13.725 -1.433 1.00 0.00 C ATOM 346 CD LYS A 25 -10.857 -12.952 -1.274 1.00 0.00 C ATOM 347 CE LYS A 25 -12.045 -13.886 -1.098 1.00 0.00 C ATOM 348 NZ LYS A 25 -13.332 -13.217 -1.435 1.00 0.00 N ATOM 0 H LYS A 25 -6.319 -14.694 -0.360 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.248 -13.195 -2.739 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.232 -13.136 0.137 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.590 -11.865 -1.015 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.409 -13.973 -2.484 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.627 -14.667 -0.889 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.783 -12.289 -0.412 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.015 -12.321 -2.149 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.915 -14.763 -1.732 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.079 -14.240 -0.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.117 -13.887 -1.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.469 -12.395 -0.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.310 -12.901 -2.426 1.00 0.00 H new ATOM 362 N LEU A 26 -5.888 -11.173 -2.163 1.00 0.00 N ATOM 363 CA LEU A 26 -4.920 -10.105 -1.942 1.00 0.00 C ATOM 364 C LEU A 26 -5.589 -8.881 -1.325 1.00 0.00 C ATOM 365 O LEU A 26 -6.409 -8.222 -1.965 1.00 0.00 O ATOM 366 CB LEU A 26 -4.245 -9.721 -3.260 1.00 0.00 C ATOM 367 CG LEU A 26 -3.233 -8.577 -3.188 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.994 -9.007 -2.417 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.857 -8.107 -4.586 1.00 0.00 C ATOM 0 H LEU A 26 -6.445 -11.068 -3.011 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.165 -10.472 -1.247 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.740 -10.602 -3.656 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.020 -9.449 -3.976 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.694 -7.743 -2.658 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.285 -8.180 -2.376 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.277 -9.293 -1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.531 -9.857 -2.918 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.136 -7.293 -4.514 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.416 -8.934 -5.142 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.750 -7.757 -5.104 1.00 0.00 H new ATOM 381 N ILE A 27 -5.233 -8.583 -0.080 1.00 0.00 N ATOM 382 CA ILE A 27 -5.797 -7.437 0.621 1.00 0.00 C ATOM 383 C ILE A 27 -4.805 -6.280 0.670 1.00 0.00 C ATOM 384 O ILE A 27 -3.650 -6.454 1.058 1.00 0.00 O ATOM 385 CB ILE A 27 -6.212 -7.804 2.058 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.333 -8.845 2.038 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.649 -6.561 2.818 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.833 -10.273 2.045 1.00 0.00 C ATOM 0 H ILE A 27 -4.557 -9.119 0.464 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.682 -7.130 0.063 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.351 -8.234 2.570 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -7.977 -8.690 2.904 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.947 -8.688 1.151 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -6.939 -6.838 3.832 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.824 -5.850 2.858 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.498 -6.103 2.310 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.682 -10.956 2.030 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.213 -10.446 1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.243 -10.448 2.945 1.00 0.00 H new ATOM 400 N VAL A 28 -5.264 -5.096 0.276 1.00 0.00 N ATOM 401 CA VAL A 28 -4.419 -3.909 0.278 1.00 0.00 C ATOM 402 C VAL A 28 -5.145 -2.717 0.893 1.00 0.00 C ATOM 403 O VAL A 28 -6.117 -2.212 0.331 1.00 0.00 O ATOM 404 CB VAL A 28 -3.965 -3.540 -1.147 1.00 0.00 C ATOM 405 CG1 VAL A 28 -3.038 -2.335 -1.118 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.289 -4.728 -1.815 1.00 0.00 C ATOM 0 H VAL A 28 -6.217 -4.934 -0.049 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.542 -4.147 0.881 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.845 -3.276 -1.733 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.728 -2.090 -2.134 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.561 -1.484 -0.683 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.159 -2.567 -0.516 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.975 -4.450 -2.821 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.418 -5.026 -1.232 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -3.990 -5.561 -1.871 1.00 0.00 H new ATOM 416 N VAL A 29 -4.666 -2.272 2.050 1.00 0.00 N ATOM 417 CA VAL A 29 -5.268 -1.138 2.741 1.00 0.00 C ATOM 418 C VAL A 29 -4.515 0.153 2.439 1.00 0.00 C ATOM 419 O VAL A 29 -3.287 0.165 2.366 1.00 0.00 O ATOM 420 CB VAL A 29 -5.296 -1.360 4.265 1.00 0.00 C ATOM 421 CG1 VAL A 29 -6.017 -0.214 4.958 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.950 -2.692 4.597 1.00 0.00 C ATOM 0 H VAL A 29 -3.863 -2.679 2.529 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.291 -1.051 2.375 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.269 -1.385 4.631 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.027 -0.388 6.034 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.500 0.722 4.747 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.041 -0.154 4.591 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.961 -2.832 5.678 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.972 -2.699 4.219 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.386 -3.500 4.132 1.00 0.00 H new ATOM 432 N VAL A 30 -5.261 1.239 2.266 1.00 0.00 N ATOM 433 CA VAL A 30 -4.664 2.537 1.974 1.00 0.00 C ATOM 434 C VAL A 30 -4.909 3.523 3.111 1.00 0.00 C ATOM 435 O VAL A 30 -5.774 4.394 3.016 1.00 0.00 O ATOM 436 CB VAL A 30 -5.222 3.130 0.666 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.399 4.333 0.231 1.00 0.00 C ATOM 438 CG2 VAL A 30 -5.254 2.072 -0.427 1.00 0.00 C ATOM 0 H VAL A 30 -6.279 1.246 2.323 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.592 2.374 1.862 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.243 3.465 0.846 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.808 4.738 -0.694 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.433 5.097 1.008 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.366 4.027 0.068 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.651 2.508 -1.344 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.244 1.705 -0.607 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.890 1.244 -0.114 1.00 0.00 H new ATOM 448 N HIS A 31 -4.140 3.380 4.186 1.00 0.00 N ATOM 449 CA HIS A 31 -4.272 4.259 5.342 1.00 0.00 C ATOM 450 C HIS A 31 -4.405 5.715 4.906 1.00 0.00 C ATOM 451 O HIS A 31 -5.485 6.300 4.983 1.00 0.00 O ATOM 452 CB HIS A 31 -3.067 4.101 6.270 1.00 0.00 C ATOM 453 CG HIS A 31 -2.889 2.707 6.788 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.826 2.072 7.576 1.00 0.00 N ATOM 455 CD2 HIS A 31 -1.875 1.825 6.626 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.395 0.860 7.877 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.214 0.685 7.313 1.00 0.00 N ATOM 0 H HIS A 31 -3.420 2.664 4.280 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.176 3.975 5.881 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.165 4.399 5.735 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.177 4.782 7.114 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -4.713 2.475 7.879 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -0.969 1.987 6.062 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.920 0.135 8.482 1.00 0.00 H new ATOM 465 N ALA A 32 -3.300 6.294 4.447 1.00 0.00 N ATOM 466 CA ALA A 32 -3.294 7.680 3.998 1.00 0.00 C ATOM 467 C ALA A 32 -1.943 8.058 3.400 1.00 0.00 C ATOM 468 O ALA A 32 -0.945 7.367 3.612 1.00 0.00 O ATOM 469 CB ALA A 32 -3.642 8.610 5.150 1.00 0.00 C ATOM 0 H ALA A 32 -2.398 5.824 4.377 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.049 7.786 3.219 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.634 9.642 4.800 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.634 8.364 5.530 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.908 8.492 5.948 1.00 0.00 H new ATOM 475 N CYS A 33 -1.917 9.156 2.653 1.00 0.00 N ATOM 476 CA CYS A 33 -0.688 9.624 2.024 1.00 0.00 C ATOM 477 C CYS A 33 -0.253 10.964 2.610 1.00 0.00 C ATOM 478 O CYS A 33 -1.076 11.727 3.115 1.00 0.00 O ATOM 479 CB CYS A 33 -0.881 9.753 0.512 1.00 0.00 C ATOM 480 SG CYS A 33 -1.812 8.393 -0.231 1.00 0.00 S ATOM 0 H CYS A 33 -2.733 9.739 2.468 1.00 0.00 H new ATOM 0 HA CYS A 33 0.094 8.891 2.222 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.396 10.690 0.301 1.00 0.00 H new ATOM 0 HB3 CYS A 33 0.097 9.813 0.035 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.574 8.351 -1.508 1.00 0.00 H new ATOM 486 N ARG A 34 1.045 11.242 2.539 1.00 0.00 N ATOM 487 CA ARG A 34 1.589 12.488 3.064 1.00 0.00 C ATOM 488 C ARG A 34 2.690 13.026 2.156 1.00 0.00 C ATOM 489 O ARG A 34 3.193 12.316 1.286 1.00 0.00 O ATOM 490 CB ARG A 34 2.137 12.274 4.477 1.00 0.00 C ATOM 491 CG ARG A 34 3.140 11.137 4.575 1.00 0.00 C ATOM 492 CD ARG A 34 3.633 10.951 6.002 1.00 0.00 C ATOM 493 NE ARG A 34 4.814 11.763 6.283 1.00 0.00 N ATOM 494 CZ ARG A 34 5.413 11.802 7.468 1.00 0.00 C ATOM 495 NH1 ARG A 34 4.945 11.079 8.476 1.00 0.00 N ATOM 496 NH2 ARG A 34 6.484 12.566 7.646 1.00 0.00 N ATOM 0 H ARG A 34 1.739 10.621 2.123 1.00 0.00 H new ATOM 0 HA ARG A 34 0.783 13.221 3.101 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.610 13.195 4.817 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.306 12.074 5.153 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.680 10.213 4.224 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.987 11.340 3.920 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.837 11.216 6.698 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.867 9.900 6.171 1.00 0.00 H new ATOM 0 HE ARG A 34 5.200 12.331 5.529 1.00 0.00 H new ATOM 0 HH11 ARG A 34 4.123 10.490 8.343 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.407 11.111 9.385 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.847 13.123 6.873 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.944 12.596 8.556 1.00 0.00 H new ATOM 510 N ASN A 35 3.060 14.285 2.365 1.00 0.00 N ATOM 511 CA ASN A 35 4.101 14.919 1.564 1.00 0.00 C ATOM 512 C ASN A 35 3.771 14.834 0.077 1.00 0.00 C ATOM 513 O ASN A 35 4.640 14.549 -0.748 1.00 0.00 O ATOM 514 CB ASN A 35 5.455 14.260 1.836 1.00 0.00 C ATOM 515 CG ASN A 35 5.870 14.371 3.290 1.00 0.00 C ATOM 516 OD1 ASN A 35 5.748 15.432 3.903 1.00 0.00 O ATOM 517 ND2 ASN A 35 6.363 13.273 3.850 1.00 0.00 N ATOM 0 H ASN A 35 2.655 14.886 3.082 1.00 0.00 H new ATOM 0 HA ASN A 35 4.153 15.970 1.847 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.407 13.208 1.554 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.215 14.724 1.208 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.659 13.287 4.826 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.446 12.415 3.304 1.00 0.00 H new ATOM 524 N LEU A 36 2.510 15.084 -0.259 1.00 0.00 N ATOM 525 CA LEU A 36 2.065 15.037 -1.647 1.00 0.00 C ATOM 526 C LEU A 36 2.022 16.436 -2.253 1.00 0.00 C ATOM 527 O LEU A 36 0.988 17.104 -2.225 1.00 0.00 O ATOM 528 CB LEU A 36 0.683 14.387 -1.738 1.00 0.00 C ATOM 529 CG LEU A 36 0.635 12.876 -1.509 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.779 12.351 -1.703 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.603 12.165 -2.444 1.00 0.00 C ATOM 0 H LEU A 36 1.778 15.321 0.411 1.00 0.00 H new ATOM 0 HA LEU A 36 2.780 14.438 -2.212 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.030 14.866 -1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.269 14.598 -2.724 1.00 0.00 H new ATOM 0 HG LEU A 36 0.937 12.673 -0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.793 11.274 -1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.448 12.837 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.110 12.565 -2.719 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.556 11.090 -2.268 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.331 12.375 -3.478 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.617 12.520 -2.257 1.00 0.00 H new ATOM 543 N ILE A 37 3.151 16.871 -2.803 1.00 0.00 N ATOM 544 CA ILE A 37 3.241 18.189 -3.420 1.00 0.00 C ATOM 545 C ILE A 37 2.044 18.455 -4.327 1.00 0.00 C ATOM 546 O ILE A 37 1.458 17.528 -4.886 1.00 0.00 O ATOM 547 CB ILE A 37 4.536 18.339 -4.240 1.00 0.00 C ATOM 548 CG1 ILE A 37 4.488 17.441 -5.478 1.00 0.00 C ATOM 549 CG2 ILE A 37 5.747 18.006 -3.382 1.00 0.00 C ATOM 550 CD1 ILE A 37 3.713 18.041 -6.630 1.00 0.00 C ATOM 0 H ILE A 37 4.015 16.330 -2.834 1.00 0.00 H new ATOM 0 HA ILE A 37 3.248 18.917 -2.609 1.00 0.00 H new ATOM 0 HB ILE A 37 4.623 19.374 -4.570 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.507 17.233 -5.805 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.039 16.486 -5.207 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.655 18.116 -3.975 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.786 18.684 -2.529 1.00 0.00 H new ATOM 0 HG23 ILE A 37 5.669 16.979 -3.026 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.721 17.350 -7.473 1.00 0.00 H new ATOM 0 HD12 ILE A 37 2.684 18.224 -6.320 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.175 18.982 -6.928 1.00 0.00 H new ATOM 562 N ALA A 38 1.687 19.727 -4.469 1.00 0.00 N ATOM 563 CA ALA A 38 0.563 20.115 -5.311 1.00 0.00 C ATOM 564 C ALA A 38 1.026 20.974 -6.483 1.00 0.00 C ATOM 565 O ALA A 38 1.718 21.975 -6.297 1.00 0.00 O ATOM 566 CB ALA A 38 -0.480 20.859 -4.490 1.00 0.00 C ATOM 0 H ALA A 38 2.160 20.506 -4.012 1.00 0.00 H new ATOM 0 HA ALA A 38 0.113 19.208 -5.714 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.314 21.143 -5.132 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.842 20.213 -3.690 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -0.033 21.755 -4.059 1.00 0.00 H new ATOM 572 N PHE A 39 0.640 20.576 -7.691 1.00 0.00 N ATOM 573 CA PHE A 39 1.018 21.309 -8.894 1.00 0.00 C ATOM 574 C PHE A 39 0.748 22.802 -8.729 1.00 0.00 C ATOM 575 O PHE A 39 1.373 23.633 -9.387 1.00 0.00 O ATOM 576 CB PHE A 39 0.252 20.772 -10.105 1.00 0.00 C ATOM 577 CG PHE A 39 1.007 20.902 -11.397 1.00 0.00 C ATOM 578 CD1 PHE A 39 1.134 22.133 -12.020 1.00 0.00 C ATOM 579 CD2 PHE A 39 1.589 19.793 -11.989 1.00 0.00 C ATOM 580 CE1 PHE A 39 1.827 22.255 -13.209 1.00 0.00 C ATOM 581 CE2 PHE A 39 2.284 19.908 -13.178 1.00 0.00 C ATOM 582 CZ PHE A 39 2.404 21.141 -13.788 1.00 0.00 C ATOM 0 H PHE A 39 0.066 19.750 -7.863 1.00 0.00 H new ATOM 0 HA PHE A 39 2.087 21.167 -9.055 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.013 19.722 -9.937 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.695 21.305 -10.191 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.686 23.007 -11.571 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.498 18.827 -11.515 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.918 23.220 -13.685 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.732 19.035 -13.629 1.00 0.00 H new ATOM 0 HZ PHE A 39 2.948 21.234 -14.716 1.00 0.00 H new ATOM 592 N SER A 40 -0.187 23.134 -7.844 1.00 0.00 N ATOM 593 CA SER A 40 -0.543 24.526 -7.595 1.00 0.00 C ATOM 594 C SER A 40 -0.908 24.739 -6.129 1.00 0.00 C ATOM 595 O SER A 40 -1.858 24.143 -5.622 1.00 0.00 O ATOM 596 CB SER A 40 -1.712 24.943 -8.489 1.00 0.00 C ATOM 597 OG SER A 40 -2.200 26.223 -8.125 1.00 0.00 O ATOM 0 H SER A 40 -0.711 22.458 -7.288 1.00 0.00 H new ATOM 0 HA SER A 40 0.323 25.145 -7.830 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.391 24.955 -9.531 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.514 24.209 -8.411 1.00 0.00 H new ATOM 0 HG SER A 40 -2.946 26.468 -8.712 1.00 0.00 H new ATOM 603 N GLU A 41 -0.145 25.592 -5.453 1.00 0.00 N ATOM 604 CA GLU A 41 -0.387 25.883 -4.045 1.00 0.00 C ATOM 605 C GLU A 41 -1.883 25.968 -3.756 1.00 0.00 C ATOM 606 O GLU A 41 -2.369 25.412 -2.771 1.00 0.00 O ATOM 607 CB GLU A 41 0.295 27.194 -3.647 1.00 0.00 C ATOM 608 CG GLU A 41 -0.159 28.389 -4.467 1.00 0.00 C ATOM 609 CD GLU A 41 0.810 29.553 -4.387 1.00 0.00 C ATOM 610 OE1 GLU A 41 1.243 29.887 -3.264 1.00 0.00 O ATOM 611 OE2 GLU A 41 1.134 30.130 -5.446 1.00 0.00 O ATOM 0 H GLU A 41 0.646 26.093 -5.858 1.00 0.00 H new ATOM 0 HA GLU A 41 0.034 25.069 -3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.098 27.391 -2.593 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.374 27.080 -3.754 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -0.274 28.088 -5.508 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.140 28.713 -4.118 1.00 0.00 H new ATOM 618 N ASP A 42 -2.608 26.667 -4.623 1.00 0.00 N ATOM 619 CA ASP A 42 -4.049 26.825 -4.463 1.00 0.00 C ATOM 620 C ASP A 42 -4.674 25.558 -3.888 1.00 0.00 C ATOM 621 O ASP A 42 -5.425 25.610 -2.915 1.00 0.00 O ATOM 622 CB ASP A 42 -4.698 27.166 -5.805 1.00 0.00 C ATOM 623 CG ASP A 42 -6.085 27.758 -5.643 1.00 0.00 C ATOM 624 OD1 ASP A 42 -6.986 27.036 -5.167 1.00 0.00 O ATOM 625 OD2 ASP A 42 -6.269 28.942 -5.993 1.00 0.00 O ATOM 0 H ASP A 42 -2.221 27.133 -5.444 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.225 27.644 -3.765 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.065 27.872 -6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.760 26.265 -6.415 1.00 0.00 H new ATOM 630 N GLY A 43 -4.359 24.419 -4.499 1.00 0.00 N ATOM 631 CA GLY A 43 -4.899 23.155 -4.036 1.00 0.00 C ATOM 632 C GLY A 43 -4.867 22.083 -5.107 1.00 0.00 C ATOM 633 O GLY A 43 -4.984 22.380 -6.296 1.00 0.00 O ATOM 0 H GLY A 43 -3.739 24.350 -5.306 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.330 22.816 -3.170 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.927 23.302 -3.705 1.00 0.00 H new ATOM 637 N SER A 44 -4.705 20.832 -4.686 1.00 0.00 N ATOM 638 CA SER A 44 -4.652 19.713 -5.619 1.00 0.00 C ATOM 639 C SER A 44 -5.569 18.582 -5.163 1.00 0.00 C ATOM 640 O SER A 44 -5.883 18.461 -3.979 1.00 0.00 O ATOM 641 CB SER A 44 -3.217 19.199 -5.750 1.00 0.00 C ATOM 642 OG SER A 44 -2.594 19.096 -4.481 1.00 0.00 O ATOM 0 H SER A 44 -4.608 20.569 -3.705 1.00 0.00 H new ATOM 0 HA SER A 44 -4.995 20.066 -6.592 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.220 18.224 -6.237 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.643 19.872 -6.387 1.00 0.00 H new ATOM 0 HG SER A 44 -1.830 18.485 -4.540 1.00 0.00 H new ATOM 648 N ASP A 45 -5.996 17.756 -6.112 1.00 0.00 N ATOM 649 CA ASP A 45 -6.877 16.634 -5.810 1.00 0.00 C ATOM 650 C ASP A 45 -6.133 15.309 -5.941 1.00 0.00 C ATOM 651 O ASP A 45 -6.228 14.612 -6.952 1.00 0.00 O ATOM 652 CB ASP A 45 -8.091 16.646 -6.741 1.00 0.00 C ATOM 653 CG ASP A 45 -8.505 18.050 -7.133 1.00 0.00 C ATOM 654 OD1 ASP A 45 -8.327 18.974 -6.311 1.00 0.00 O ATOM 655 OD2 ASP A 45 -9.008 18.226 -8.263 1.00 0.00 O ATOM 0 H ASP A 45 -5.746 17.842 -7.097 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.218 16.738 -4.780 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.862 16.074 -7.640 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.927 16.147 -6.250 1.00 0.00 H new ATOM 660 N PRO A 46 -5.372 14.951 -4.896 1.00 0.00 N ATOM 661 CA PRO A 46 -4.597 13.707 -4.871 1.00 0.00 C ATOM 662 C PRO A 46 -5.485 12.471 -4.773 1.00 0.00 C ATOM 663 O PRO A 46 -6.526 12.494 -4.116 1.00 0.00 O ATOM 664 CB PRO A 46 -3.739 13.850 -3.611 1.00 0.00 C ATOM 665 CG PRO A 46 -4.505 14.779 -2.734 1.00 0.00 C ATOM 666 CD PRO A 46 -5.212 15.732 -3.658 1.00 0.00 C ATOM 0 HA PRO A 46 -4.019 13.569 -5.785 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.584 12.886 -3.126 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.753 14.251 -3.847 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.218 14.233 -2.116 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.840 15.314 -2.056 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.174 16.045 -3.253 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.628 16.637 -3.826 1.00 0.00 H new ATOM 674 N TYR A 47 -5.068 11.395 -5.430 1.00 0.00 N ATOM 675 CA TYR A 47 -5.827 10.151 -5.419 1.00 0.00 C ATOM 676 C TYR A 47 -4.931 8.963 -5.756 1.00 0.00 C ATOM 677 O TYR A 47 -4.146 9.011 -6.703 1.00 0.00 O ATOM 678 CB TYR A 47 -6.987 10.227 -6.413 1.00 0.00 C ATOM 679 CG TYR A 47 -6.617 9.781 -7.810 1.00 0.00 C ATOM 680 CD1 TYR A 47 -6.718 8.447 -8.184 1.00 0.00 C ATOM 681 CD2 TYR A 47 -6.167 10.694 -8.755 1.00 0.00 C ATOM 682 CE1 TYR A 47 -6.381 8.035 -9.459 1.00 0.00 C ATOM 683 CE2 TYR A 47 -5.829 10.292 -10.033 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.937 8.961 -10.379 1.00 0.00 C ATOM 685 OH TYR A 47 -5.600 8.556 -11.651 1.00 0.00 O ATOM 0 H TYR A 47 -4.208 11.359 -5.977 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.227 10.009 -4.415 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.808 9.609 -6.049 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.354 11.253 -6.453 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -7.066 7.719 -7.466 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -6.080 11.736 -8.486 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -6.465 6.994 -9.733 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.482 11.015 -10.756 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.308 9.331 -12.174 1.00 0.00 H new ATOM 695 N VAL A 48 -5.055 7.895 -4.973 1.00 0.00 N ATOM 696 CA VAL A 48 -4.259 6.693 -5.187 1.00 0.00 C ATOM 697 C VAL A 48 -4.914 5.776 -6.214 1.00 0.00 C ATOM 698 O VAL A 48 -6.138 5.660 -6.266 1.00 0.00 O ATOM 699 CB VAL A 48 -4.055 5.913 -3.875 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.389 4.573 -4.148 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.237 6.734 -2.889 1.00 0.00 C ATOM 0 H VAL A 48 -5.700 7.839 -4.185 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.289 7.019 -5.561 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.032 5.722 -3.431 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.253 4.036 -3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.018 3.983 -4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.418 4.738 -4.616 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.103 6.168 -1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.262 6.958 -3.323 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.759 7.665 -2.670 1.00 0.00 H new ATOM 711 N ARG A 49 -4.090 5.127 -7.030 1.00 0.00 N ATOM 712 CA ARG A 49 -4.589 4.220 -8.057 1.00 0.00 C ATOM 713 C ARG A 49 -3.938 2.846 -7.932 1.00 0.00 C ATOM 714 O ARG A 49 -2.718 2.734 -7.816 1.00 0.00 O ATOM 715 CB ARG A 49 -4.324 4.797 -9.449 1.00 0.00 C ATOM 716 CG ARG A 49 -4.604 3.818 -10.577 1.00 0.00 C ATOM 717 CD ARG A 49 -4.181 4.384 -11.924 1.00 0.00 C ATOM 718 NE ARG A 49 -5.250 5.155 -12.554 1.00 0.00 N ATOM 719 CZ ARG A 49 -5.268 5.467 -13.845 1.00 0.00 C ATOM 720 NH1 ARG A 49 -4.281 5.076 -14.639 1.00 0.00 N ATOM 721 NH2 ARG A 49 -6.275 6.172 -14.344 1.00 0.00 N ATOM 0 H ARG A 49 -3.074 5.212 -7.000 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.664 4.108 -7.916 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.941 5.685 -9.588 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.284 5.118 -9.508 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.073 2.885 -10.390 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.668 3.581 -10.599 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -3.305 5.020 -11.791 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -3.886 3.568 -12.583 1.00 0.00 H new ATOM 0 HE ARG A 49 -6.025 5.471 -11.971 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.505 4.534 -14.259 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -4.298 5.317 -15.630 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -7.036 6.475 -13.736 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -6.288 6.411 -15.335 1.00 0.00 H new ATOM 735 N MET A 50 -4.761 1.803 -7.956 1.00 0.00 N ATOM 736 CA MET A 50 -4.265 0.436 -7.846 1.00 0.00 C ATOM 737 C MET A 50 -4.554 -0.352 -9.120 1.00 0.00 C ATOM 738 O MET A 50 -5.641 -0.253 -9.689 1.00 0.00 O ATOM 739 CB MET A 50 -4.902 -0.265 -6.645 1.00 0.00 C ATOM 740 CG MET A 50 -4.309 0.157 -5.310 1.00 0.00 C ATOM 741 SD MET A 50 -4.764 -0.954 -3.965 1.00 0.00 S ATOM 742 CE MET A 50 -6.363 -0.290 -3.504 1.00 0.00 C ATOM 0 H MET A 50 -5.774 1.878 -8.051 1.00 0.00 H new ATOM 0 HA MET A 50 -3.185 0.479 -7.703 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.972 -0.058 -6.640 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.786 -1.343 -6.760 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.223 0.193 -5.395 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.644 1.166 -5.071 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.428 -0.218 -2.418 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.485 0.701 -3.941 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.150 -0.948 -3.872 1.00 0.00 H new ATOM 752 N TYR A 51 -3.574 -1.131 -9.563 1.00 0.00 N ATOM 753 CA TYR A 51 -3.722 -1.933 -10.772 1.00 0.00 C ATOM 754 C TYR A 51 -2.841 -3.177 -10.712 1.00 0.00 C ATOM 755 O TYR A 51 -1.613 -3.085 -10.724 1.00 0.00 O ATOM 756 CB TYR A 51 -3.367 -1.103 -12.007 1.00 0.00 C ATOM 757 CG TYR A 51 -4.547 -0.367 -12.600 1.00 0.00 C ATOM 758 CD1 TYR A 51 -5.640 -1.059 -13.105 1.00 0.00 C ATOM 759 CD2 TYR A 51 -4.568 1.022 -12.656 1.00 0.00 C ATOM 760 CE1 TYR A 51 -6.720 -0.390 -13.650 1.00 0.00 C ATOM 761 CE2 TYR A 51 -5.643 1.699 -13.197 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.717 0.989 -13.693 1.00 0.00 C ATOM 763 OH TYR A 51 -7.791 1.658 -14.233 1.00 0.00 O ATOM 0 H TYR A 51 -2.668 -1.224 -9.103 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.763 -2.249 -10.842 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.596 -0.381 -11.740 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.940 -1.759 -12.765 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -5.646 -2.138 -13.071 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -3.729 1.581 -12.270 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -7.561 -0.944 -14.040 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.643 2.778 -13.232 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.632 2.624 -14.186 1.00 0.00 H new ATOM 773 N LEU A 52 -3.477 -4.342 -10.647 1.00 0.00 N ATOM 774 CA LEU A 52 -2.753 -5.607 -10.585 1.00 0.00 C ATOM 775 C LEU A 52 -2.133 -5.945 -11.937 1.00 0.00 C ATOM 776 O LEU A 52 -2.778 -6.550 -12.794 1.00 0.00 O ATOM 777 CB LEU A 52 -3.691 -6.733 -10.145 1.00 0.00 C ATOM 778 CG LEU A 52 -3.023 -8.060 -9.785 1.00 0.00 C ATOM 779 CD1 LEU A 52 -1.776 -7.820 -8.947 1.00 0.00 C ATOM 780 CD2 LEU A 52 -3.998 -8.964 -9.045 1.00 0.00 C ATOM 0 H LEU A 52 -4.493 -4.437 -10.636 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.951 -5.504 -9.854 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.259 -6.389 -9.281 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.408 -6.915 -10.946 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.726 -8.557 -10.708 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.314 -8.776 -8.700 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.070 -7.211 -9.511 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.049 -7.301 -8.028 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.506 -9.904 -8.797 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.326 -8.473 -8.129 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.862 -9.163 -9.679 1.00 0.00 H new ATOM 792 N LEU A 53 -0.877 -5.553 -12.120 1.00 0.00 N ATOM 793 CA LEU A 53 -0.167 -5.817 -13.367 1.00 0.00 C ATOM 794 C LEU A 53 0.037 -7.315 -13.571 1.00 0.00 C ATOM 795 O LEU A 53 0.114 -8.091 -12.619 1.00 0.00 O ATOM 796 CB LEU A 53 1.185 -5.101 -13.369 1.00 0.00 C ATOM 797 CG LEU A 53 1.136 -3.573 -13.325 1.00 0.00 C ATOM 798 CD1 LEU A 53 2.513 -3.003 -13.022 1.00 0.00 C ATOM 799 CD2 LEU A 53 0.604 -3.019 -14.639 1.00 0.00 C ATOM 0 H LEU A 53 -0.329 -5.051 -11.421 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.773 -5.437 -14.189 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.760 -5.451 -12.512 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.731 -5.401 -14.263 1.00 0.00 H new ATOM 0 HG LEU A 53 0.458 -3.273 -12.526 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.458 -1.915 -12.995 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.856 -3.373 -12.056 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.213 -3.312 -13.798 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.576 -1.930 -14.590 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.257 -3.329 -15.455 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.402 -3.400 -14.814 1.00 0.00 H new ATOM 811 N PRO A 54 0.130 -7.732 -14.842 1.00 0.00 N ATOM 812 CA PRO A 54 0.040 -6.817 -15.984 1.00 0.00 C ATOM 813 C PRO A 54 -1.366 -6.256 -16.168 1.00 0.00 C ATOM 814 O PRO A 54 -1.538 -5.105 -16.569 1.00 0.00 O ATOM 815 CB PRO A 54 0.424 -7.698 -17.176 1.00 0.00 C ATOM 816 CG PRO A 54 0.087 -9.084 -16.747 1.00 0.00 C ATOM 817 CD PRO A 54 0.330 -9.129 -15.263 1.00 0.00 C ATOM 0 HA PRO A 54 0.680 -5.944 -15.858 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.129 -7.415 -18.072 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.484 -7.604 -17.413 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.951 -9.323 -16.980 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.707 -9.815 -17.266 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -0.365 -9.803 -14.762 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.336 -9.479 -15.031 1.00 0.00 H new ATOM 825 N ASP A 55 -2.368 -7.076 -15.873 1.00 0.00 N ATOM 826 CA ASP A 55 -3.760 -6.661 -16.004 1.00 0.00 C ATOM 827 C ASP A 55 -3.926 -5.192 -15.629 1.00 0.00 C ATOM 828 O ASP A 55 -3.818 -4.822 -14.459 1.00 0.00 O ATOM 829 CB ASP A 55 -4.659 -7.530 -15.123 1.00 0.00 C ATOM 830 CG ASP A 55 -5.047 -8.831 -15.798 1.00 0.00 C ATOM 831 OD1 ASP A 55 -6.070 -8.846 -16.514 1.00 0.00 O ATOM 832 OD2 ASP A 55 -4.328 -9.835 -15.610 1.00 0.00 O ATOM 0 H ASP A 55 -2.243 -8.032 -15.541 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.055 -6.787 -17.046 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.144 -7.749 -14.187 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.561 -6.973 -14.868 1.00 0.00 H new ATOM 837 N LYS A 56 -4.189 -4.357 -16.629 1.00 0.00 N ATOM 838 CA LYS A 56 -4.371 -2.928 -16.405 1.00 0.00 C ATOM 839 C LYS A 56 -5.710 -2.456 -16.963 1.00 0.00 C ATOM 840 O LYS A 56 -5.940 -1.257 -17.120 1.00 0.00 O ATOM 841 CB LYS A 56 -3.231 -2.140 -17.054 1.00 0.00 C ATOM 842 CG LYS A 56 -2.040 -1.925 -16.135 1.00 0.00 C ATOM 843 CD LYS A 56 -1.169 -0.775 -16.612 1.00 0.00 C ATOM 844 CE LYS A 56 -1.823 0.570 -16.339 1.00 0.00 C ATOM 845 NZ LYS A 56 -1.009 1.700 -16.865 1.00 0.00 N ATOM 0 H LYS A 56 -4.281 -4.646 -17.603 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.362 -2.750 -15.330 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.899 -2.668 -17.948 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -3.609 -1.170 -17.378 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.392 -1.721 -15.124 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -1.446 -2.838 -16.088 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.201 -0.818 -16.112 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.981 -0.879 -17.681 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.812 0.592 -16.796 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.965 0.694 -15.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.489 2.599 -16.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.073 1.695 -16.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.895 1.596 -17.894 1.00 0.00 H new ATOM 859 N ARG A 57 -6.591 -3.407 -17.258 1.00 0.00 N ATOM 860 CA ARG A 57 -7.907 -3.087 -17.798 1.00 0.00 C ATOM 861 C ARG A 57 -8.723 -2.276 -16.796 1.00 0.00 C ATOM 862 O ARG A 57 -8.761 -2.596 -15.607 1.00 0.00 O ATOM 863 CB ARG A 57 -8.657 -4.370 -18.162 1.00 0.00 C ATOM 864 CG ARG A 57 -8.056 -5.112 -19.345 1.00 0.00 C ATOM 865 CD ARG A 57 -8.351 -6.602 -19.276 1.00 0.00 C ATOM 866 NE ARG A 57 -8.404 -7.211 -20.603 1.00 0.00 N ATOM 867 CZ ARG A 57 -7.326 -7.504 -21.321 1.00 0.00 C ATOM 868 NH1 ARG A 57 -6.116 -7.245 -20.843 1.00 0.00 N ATOM 869 NH2 ARG A 57 -7.456 -8.057 -22.520 1.00 0.00 N ATOM 0 H ARG A 57 -6.417 -4.404 -17.132 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.767 -2.487 -18.697 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.668 -5.032 -17.296 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -9.694 -4.123 -18.388 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.456 -4.703 -20.273 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.978 -4.954 -19.365 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.584 -7.096 -18.681 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.301 -6.760 -18.766 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.319 -7.423 -21.000 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -6.012 -6.820 -19.922 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.290 -7.471 -21.397 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -8.385 -8.257 -22.891 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -6.627 -8.282 -23.071 1.00 0.00 H new ATOM 883 N ARG A 58 -9.374 -1.225 -17.284 1.00 0.00 N ATOM 884 CA ARG A 58 -10.187 -0.366 -16.431 1.00 0.00 C ATOM 885 C ARG A 58 -11.381 -1.133 -15.869 1.00 0.00 C ATOM 886 O ARG A 58 -12.000 -0.709 -14.893 1.00 0.00 O ATOM 887 CB ARG A 58 -10.674 0.854 -17.215 1.00 0.00 C ATOM 888 CG ARG A 58 -11.748 0.530 -18.241 1.00 0.00 C ATOM 889 CD ARG A 58 -11.156 -0.127 -19.478 1.00 0.00 C ATOM 890 NE ARG A 58 -12.002 0.060 -20.654 1.00 0.00 N ATOM 891 CZ ARG A 58 -11.593 -0.169 -21.897 1.00 0.00 C ATOM 892 NH1 ARG A 58 -10.356 -0.591 -22.125 1.00 0.00 N ATOM 893 NH2 ARG A 58 -12.421 0.025 -22.916 1.00 0.00 N ATOM 0 H ARG A 58 -9.354 -0.948 -18.265 1.00 0.00 H new ATOM 0 HA ARG A 58 -9.568 -0.031 -15.599 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -11.063 1.593 -16.515 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -9.825 1.312 -17.723 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -12.490 -0.132 -17.796 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -12.268 1.445 -18.527 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -10.168 0.290 -19.672 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -11.022 -1.193 -19.294 1.00 0.00 H new ATOM 0 HE ARG A 58 -12.959 0.384 -20.513 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -9.716 -0.740 -21.345 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -10.045 -0.766 -23.080 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -13.373 0.350 -22.745 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -12.106 -0.151 -23.870 1.00 0.00 H new ATOM 907 N SER A 59 -11.700 -2.262 -16.494 1.00 0.00 N ATOM 908 CA SER A 59 -12.822 -3.085 -16.059 1.00 0.00 C ATOM 909 C SER A 59 -12.774 -3.318 -14.552 1.00 0.00 C ATOM 910 O SER A 59 -13.605 -2.803 -13.806 1.00 0.00 O ATOM 911 CB SER A 59 -12.813 -4.427 -16.794 1.00 0.00 C ATOM 912 OG SER A 59 -13.536 -4.347 -18.010 1.00 0.00 O ATOM 0 H SER A 59 -11.197 -2.627 -17.303 1.00 0.00 H new ATOM 0 HA SER A 59 -13.743 -2.554 -16.298 1.00 0.00 H new ATOM 0 HB2 SER A 59 -11.785 -4.727 -16.998 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.250 -5.197 -16.158 1.00 0.00 H new ATOM 0 HG SER A 59 -13.514 -5.217 -18.462 1.00 0.00 H new ATOM 918 N GLY A 60 -11.792 -4.099 -14.111 1.00 0.00 N ATOM 919 CA GLY A 60 -11.652 -4.387 -12.696 1.00 0.00 C ATOM 920 C GLY A 60 -10.720 -3.419 -11.996 1.00 0.00 C ATOM 921 O GLY A 60 -9.821 -3.831 -11.263 1.00 0.00 O ATOM 0 H GLY A 60 -11.091 -4.537 -14.709 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.633 -4.349 -12.222 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -11.277 -5.403 -12.571 1.00 0.00 H new ATOM 925 N ARG A 61 -10.933 -2.127 -12.223 1.00 0.00 N ATOM 926 CA ARG A 61 -10.102 -1.096 -11.611 1.00 0.00 C ATOM 927 C ARG A 61 -10.621 -0.734 -10.222 1.00 0.00 C ATOM 928 O ARG A 61 -11.828 -0.635 -10.006 1.00 0.00 O ATOM 929 CB ARG A 61 -10.066 0.152 -12.495 1.00 0.00 C ATOM 930 CG ARG A 61 -9.639 1.409 -11.756 1.00 0.00 C ATOM 931 CD ARG A 61 -10.832 2.137 -11.158 1.00 0.00 C ATOM 932 NE ARG A 61 -11.442 3.062 -12.110 1.00 0.00 N ATOM 933 CZ ARG A 61 -12.471 3.849 -11.814 1.00 0.00 C ATOM 934 NH1 ARG A 61 -13.002 3.823 -10.599 1.00 0.00 N ATOM 935 NH2 ARG A 61 -12.971 4.664 -12.734 1.00 0.00 N ATOM 0 H ARG A 61 -11.674 -1.769 -12.826 1.00 0.00 H new ATOM 0 HA ARG A 61 -9.091 -1.491 -11.511 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -9.382 -0.021 -13.326 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -11.055 0.311 -12.925 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -8.938 1.146 -10.964 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -9.112 2.073 -12.441 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -11.575 1.409 -10.833 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -10.515 2.686 -10.272 1.00 0.00 H new ATOM 0 HE ARG A 61 -11.057 3.106 -13.054 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -12.621 3.198 -9.889 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -13.792 4.428 -10.375 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -12.566 4.687 -13.670 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.761 5.268 -12.506 1.00 0.00 H new ATOM 949 N ARG A 62 -9.699 -0.538 -9.285 1.00 0.00 N ATOM 950 CA ARG A 62 -10.063 -0.189 -7.917 1.00 0.00 C ATOM 951 C ARG A 62 -9.167 0.925 -7.384 1.00 0.00 C ATOM 952 O ARG A 62 -7.970 0.727 -7.173 1.00 0.00 O ATOM 953 CB ARG A 62 -9.962 -1.417 -7.010 1.00 0.00 C ATOM 954 CG ARG A 62 -11.087 -2.418 -7.214 1.00 0.00 C ATOM 955 CD ARG A 62 -12.387 -1.930 -6.593 1.00 0.00 C ATOM 956 NE ARG A 62 -13.490 -2.856 -6.832 1.00 0.00 N ATOM 957 CZ ARG A 62 -14.076 -3.011 -8.014 1.00 0.00 C ATOM 958 NH1 ARG A 62 -13.667 -2.305 -9.058 1.00 0.00 N ATOM 959 NH2 ARG A 62 -15.075 -3.874 -8.152 1.00 0.00 N ATOM 0 H ARG A 62 -8.695 -0.615 -9.448 1.00 0.00 H new ATOM 0 HA ARG A 62 -11.093 0.167 -7.921 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -9.008 -1.913 -7.189 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.961 -1.091 -5.970 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.234 -2.589 -8.280 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.808 -3.375 -6.773 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.249 -1.800 -5.520 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.640 -0.952 -7.003 1.00 0.00 H new ATOM 0 HE ARG A 62 -13.829 -3.414 -6.049 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.900 -1.640 -8.955 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -14.119 -2.426 -9.964 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -15.393 -4.418 -7.350 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -15.525 -3.993 -9.060 1.00 0.00 H new ATOM 973 N LYS A 63 -9.754 2.097 -7.168 1.00 0.00 N ATOM 974 CA LYS A 63 -9.011 3.244 -6.659 1.00 0.00 C ATOM 975 C LYS A 63 -9.738 3.883 -5.480 1.00 0.00 C ATOM 976 O LYS A 63 -10.884 3.544 -5.186 1.00 0.00 O ATOM 977 CB LYS A 63 -8.807 4.279 -7.768 1.00 0.00 C ATOM 978 CG LYS A 63 -10.092 4.956 -8.212 1.00 0.00 C ATOM 979 CD LYS A 63 -9.810 6.234 -8.984 1.00 0.00 C ATOM 980 CE LYS A 63 -9.429 5.940 -10.427 1.00 0.00 C ATOM 981 NZ LYS A 63 -9.798 7.060 -11.337 1.00 0.00 N ATOM 0 H LYS A 63 -10.743 2.278 -7.338 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.038 2.892 -6.316 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.107 5.039 -7.420 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.347 3.792 -8.628 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.668 4.272 -8.836 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.704 5.184 -7.340 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -10.691 6.875 -8.962 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.004 6.784 -8.498 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.356 5.759 -10.490 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.926 5.027 -10.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.522 6.821 -12.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.825 7.216 -11.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -9.304 7.926 -11.040 1.00 0.00 H new ATOM 995 N THR A 64 -9.064 4.812 -4.808 1.00 0.00 N ATOM 996 CA THR A 64 -9.645 5.499 -3.662 1.00 0.00 C ATOM 997 C THR A 64 -10.249 6.837 -4.071 1.00 0.00 C ATOM 998 O THR A 64 -9.909 7.388 -5.119 1.00 0.00 O ATOM 999 CB THR A 64 -8.597 5.737 -2.559 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.465 6.428 -3.100 1.00 0.00 O ATOM 1001 CG2 THR A 64 -8.147 4.420 -1.945 1.00 0.00 C ATOM 0 H THR A 64 -8.115 5.105 -5.039 1.00 0.00 H new ATOM 0 HA THR A 64 -10.431 4.853 -3.272 1.00 0.00 H new ATOM 0 HB THR A 64 -9.055 6.345 -1.779 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.017 6.930 -2.388 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.407 4.615 -1.169 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.006 3.910 -1.508 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.706 3.790 -2.718 1.00 0.00 H new ATOM 1009 N HIS A 65 -11.146 7.356 -3.239 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.796 8.632 -3.514 1.00 0.00 C ATOM 1011 C HIS A 65 -10.763 9.720 -3.789 1.00 0.00 C ATOM 1012 O HIS A 65 -9.570 9.533 -3.550 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.683 9.041 -2.338 1.00 0.00 C ATOM 1014 CG HIS A 65 -13.959 8.261 -2.250 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -15.157 8.718 -2.758 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -14.220 7.047 -1.712 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -16.099 7.820 -2.533 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -15.556 6.796 -1.900 1.00 0.00 N ATOM 0 H HIS A 65 -11.439 6.912 -2.369 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.416 8.511 -4.402 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -12.124 8.914 -1.411 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -12.920 10.101 -2.424 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -13.509 6.396 -1.225 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -17.137 7.908 -2.818 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -16.049 5.955 -1.600 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.229 10.858 -4.295 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.346 11.977 -4.603 1.00 0.00 C ATOM 1028 C VAL A 66 -10.573 13.137 -3.640 1.00 0.00 C ATOM 1029 O VAL A 66 -11.604 13.807 -3.691 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.552 12.474 -6.046 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.696 13.702 -6.315 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.239 11.366 -7.040 1.00 0.00 C ATOM 0 H VAL A 66 -12.213 11.029 -4.500 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.324 11.613 -4.495 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.598 12.756 -6.170 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.855 14.039 -7.339 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.974 14.498 -5.624 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.645 13.451 -6.175 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.390 11.734 -8.055 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.203 11.050 -6.919 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -10.900 10.518 -6.860 1.00 0.00 H new ATOM 1042 N SER A 67 -9.601 13.369 -2.763 1.00 0.00 N ATOM 1043 CA SER A 67 -9.696 14.447 -1.786 1.00 0.00 C ATOM 1044 C SER A 67 -9.517 15.806 -2.456 1.00 0.00 C ATOM 1045 O SER A 67 -8.789 15.935 -3.441 1.00 0.00 O ATOM 1046 CB SER A 67 -8.644 14.264 -0.690 1.00 0.00 C ATOM 1047 OG SER A 67 -7.388 14.777 -1.098 1.00 0.00 O ATOM 0 H SER A 67 -8.740 12.825 -2.709 1.00 0.00 H new ATOM 0 HA SER A 67 -10.689 14.411 -1.338 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.969 14.770 0.219 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.547 13.206 -0.448 1.00 0.00 H new ATOM 0 HG SER A 67 -7.241 14.567 -2.044 1.00 0.00 H new ATOM 1053 N LYS A 68 -10.185 16.818 -1.915 1.00 0.00 N ATOM 1054 CA LYS A 68 -10.101 18.169 -2.457 1.00 0.00 C ATOM 1055 C LYS A 68 -9.586 19.147 -1.406 1.00 0.00 C ATOM 1056 O LYS A 68 -9.947 19.060 -0.232 1.00 0.00 O ATOM 1057 CB LYS A 68 -11.471 18.624 -2.964 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.969 17.834 -4.163 1.00 0.00 C ATOM 1059 CD LYS A 68 -12.853 18.683 -5.061 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.038 19.400 -6.128 1.00 0.00 C ATOM 1061 NZ LYS A 68 -12.905 20.165 -7.067 1.00 0.00 N ATOM 0 H LYS A 68 -10.792 16.728 -1.100 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.398 18.155 -3.290 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -12.196 18.536 -2.155 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -11.418 19.679 -3.231 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -11.118 17.463 -4.734 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.527 16.963 -3.820 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -13.603 18.052 -5.537 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -13.390 19.415 -4.458 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.332 20.079 -5.650 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -11.451 18.672 -6.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -12.313 20.639 -7.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -13.562 19.513 -7.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -13.447 20.877 -6.537 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.741 20.078 -1.834 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.178 21.075 -0.931 1.00 0.00 C ATOM 1077 C LYS A 69 -7.452 20.407 0.232 1.00 0.00 C ATOM 1078 O LYS A 69 -7.689 20.734 1.396 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.282 21.992 -0.399 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.760 23.019 -1.411 1.00 0.00 C ATOM 1081 CD LYS A 69 -10.627 22.381 -2.484 1.00 0.00 C ATOM 1082 CE LYS A 69 -11.600 23.385 -3.084 1.00 0.00 C ATOM 1083 NZ LYS A 69 -10.927 24.305 -4.042 1.00 0.00 N ATOM 0 H LYS A 69 -8.430 20.163 -2.802 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.458 21.671 -1.491 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -10.129 21.382 -0.085 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.916 22.511 0.487 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -10.326 23.799 -0.901 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -8.900 23.501 -1.876 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -9.993 21.973 -3.271 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -11.182 21.546 -2.056 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -12.402 22.853 -3.595 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -12.061 23.966 -2.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -11.623 24.974 -4.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -10.178 24.832 -3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -10.509 23.753 -4.818 1.00 0.00 H new ATOM 1097 N THR A 70 -6.566 19.470 -0.089 1.00 0.00 N ATOM 1098 CA THR A 70 -5.806 18.756 0.929 1.00 0.00 C ATOM 1099 C THR A 70 -4.598 18.052 0.321 1.00 0.00 C ATOM 1100 O THR A 70 -4.666 17.530 -0.792 1.00 0.00 O ATOM 1101 CB THR A 70 -6.679 17.717 1.657 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.875 16.947 2.559 1.00 0.00 O ATOM 1103 CG2 THR A 70 -7.361 16.791 0.661 1.00 0.00 C ATOM 0 H THR A 70 -6.357 19.188 -1.047 1.00 0.00 H new ATOM 0 HA THR A 70 -5.465 19.501 1.648 1.00 0.00 H new ATOM 0 HB THR A 70 -7.446 18.249 2.219 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.438 16.290 3.019 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.972 16.066 1.198 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.994 17.376 -0.005 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.606 16.266 0.076 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.493 18.040 1.058 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.269 17.399 0.592 1.00 0.00 C ATOM 1113 C LEU A 71 -2.122 16.004 1.191 1.00 0.00 C ATOM 1114 O LEU A 71 -1.555 15.107 0.569 1.00 0.00 O ATOM 1115 CB LEU A 71 -1.052 18.252 0.954 1.00 0.00 C ATOM 1116 CG LEU A 71 -1.010 19.654 0.344 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.289 20.356 0.708 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -1.174 19.583 -1.167 1.00 0.00 C ATOM 0 H LEU A 71 -3.420 18.467 1.981 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.329 17.305 -0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.010 18.348 2.039 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.154 17.717 0.647 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.839 20.232 0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.301 21.352 0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.366 20.440 1.792 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.133 19.780 0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.142 20.589 -1.584 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.367 18.988 -1.593 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -2.131 19.121 -1.408 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.639 15.829 2.403 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.567 14.542 3.086 1.00 0.00 C ATOM 1132 C ASN A 72 -3.941 13.882 3.148 1.00 0.00 C ATOM 1133 O ASN A 72 -4.647 13.954 4.154 1.00 0.00 O ATOM 1134 CB ASN A 72 -2.011 14.723 4.500 1.00 0.00 C ATOM 1135 CG ASN A 72 -0.634 15.358 4.503 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -0.146 15.812 3.469 1.00 0.00 O ATOM 1137 ND2 ASN A 72 -0.001 15.392 5.670 1.00 0.00 N ATOM 0 H ASN A 72 -3.112 16.562 2.932 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.898 13.894 2.520 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.695 15.343 5.080 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -1.962 13.753 4.995 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.929 15.807 5.734 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -0.444 15.003 6.502 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.331 13.222 2.047 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.622 12.535 1.952 1.00 0.00 C ATOM 1146 C PRO A 73 -5.686 11.294 2.837 1.00 0.00 C ATOM 1147 O PRO A 73 -4.683 10.608 3.033 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.707 12.142 0.475 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.289 12.056 0.024 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.540 13.095 0.811 1.00 0.00 C ATOM 0 HA PRO A 73 -6.445 13.166 2.288 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.221 11.190 0.348 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.261 12.883 -0.101 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.882 11.061 0.205 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.208 12.244 -1.047 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.517 12.782 1.019 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.480 14.041 0.273 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.871 11.013 3.369 1.00 0.00 N ATOM 1159 CA VAL A 74 -7.065 9.854 4.232 1.00 0.00 C ATOM 1160 C VAL A 74 -8.282 9.044 3.799 1.00 0.00 C ATOM 1161 O VAL A 74 -9.414 9.526 3.854 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.239 10.273 5.704 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.441 9.051 6.587 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -6.041 11.086 6.171 1.00 0.00 C ATOM 0 H VAL A 74 -7.711 11.572 3.218 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.170 9.238 4.140 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.128 10.899 5.783 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.562 9.367 7.623 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.333 8.513 6.265 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.573 8.396 6.506 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.180 11.374 7.213 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.136 10.486 6.078 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -5.947 11.982 5.557 1.00 0.00 H new ATOM 1174 N PHE A 75 -8.042 7.810 3.368 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.118 6.932 2.924 1.00 0.00 C ATOM 1176 C PHE A 75 -9.273 5.742 3.867 1.00 0.00 C ATOM 1177 O PHE A 75 -10.387 5.300 4.148 1.00 0.00 O ATOM 1178 CB PHE A 75 -8.849 6.438 1.501 1.00 0.00 C ATOM 1179 CG PHE A 75 -8.068 7.413 0.666 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -8.660 8.575 0.200 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -6.742 7.166 0.348 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -7.944 9.474 -0.568 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -6.021 8.061 -0.420 1.00 0.00 C ATOM 1184 CZ PHE A 75 -6.623 9.216 -0.879 1.00 0.00 C ATOM 0 H PHE A 75 -7.111 7.395 3.317 1.00 0.00 H new ATOM 0 HA PHE A 75 -10.046 7.504 2.933 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.304 5.495 1.549 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.800 6.232 1.010 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.693 8.781 0.439 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.267 6.264 0.704 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -8.417 10.377 -0.925 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -4.988 7.857 -0.661 1.00 0.00 H new ATOM 0 HZ PHE A 75 -6.062 9.916 -1.480 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.147 5.228 4.350 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.157 4.089 5.261 1.00 0.00 C ATOM 1196 C ASP A 76 -9.081 2.990 4.748 1.00 0.00 C ATOM 1197 O ASP A 76 -9.737 2.303 5.530 1.00 0.00 O ATOM 1198 CB ASP A 76 -8.595 4.531 6.658 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.418 3.437 7.693 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.262 3.039 7.945 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.437 2.979 8.252 1.00 0.00 O ATOM 0 H ASP A 76 -7.217 5.581 4.126 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.144 3.690 5.315 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.018 5.406 6.957 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.642 4.834 6.629 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.128 2.831 3.429 1.00 0.00 N ATOM 1207 CA GLN A 77 -9.973 1.816 2.812 1.00 0.00 C ATOM 1208 C GLN A 77 -9.219 0.499 2.656 1.00 0.00 C ATOM 1209 O GLN A 77 -7.989 0.469 2.698 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.471 2.297 1.448 1.00 0.00 C ATOM 1211 CG GLN A 77 -11.769 3.085 1.517 1.00 0.00 C ATOM 1212 CD GLN A 77 -11.918 4.065 0.370 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -11.702 5.266 0.533 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.290 3.557 -0.799 1.00 0.00 N ATOM 0 H GLN A 77 -8.591 3.392 2.768 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.829 1.647 3.465 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.702 2.919 0.989 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.614 1.434 0.798 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.611 2.393 1.510 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.810 3.628 2.461 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.459 2.555 -0.889 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.407 4.169 -1.607 1.00 0.00 H new ATOM 1223 N SER A 78 -9.964 -0.587 2.477 1.00 0.00 N ATOM 1224 CA SER A 78 -9.365 -1.907 2.319 1.00 0.00 C ATOM 1225 C SER A 78 -9.943 -2.623 1.103 1.00 0.00 C ATOM 1226 O SER A 78 -11.143 -2.894 1.039 1.00 0.00 O ATOM 1227 CB SER A 78 -9.594 -2.748 3.577 1.00 0.00 C ATOM 1228 OG SER A 78 -9.193 -4.091 3.372 1.00 0.00 O ATOM 0 H SER A 78 -10.983 -0.579 2.438 1.00 0.00 H new ATOM 0 HA SER A 78 -8.293 -1.777 2.167 1.00 0.00 H new ATOM 0 HB2 SER A 78 -9.035 -2.321 4.410 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.648 -2.718 3.852 1.00 0.00 H new ATOM 0 HG SER A 78 -9.348 -4.607 4.190 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.081 -2.928 0.139 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.504 -3.613 -1.077 1.00 0.00 C ATOM 1236 C PHE A 79 -9.111 -5.087 -1.037 1.00 0.00 C ATOM 1237 O PHE A 79 -8.231 -5.485 -0.273 1.00 0.00 O ATOM 1238 CB PHE A 79 -8.887 -2.942 -2.306 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.285 -1.503 -2.467 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.823 -0.540 -1.584 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.119 -1.112 -3.501 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -9.188 0.785 -1.729 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.488 0.212 -3.652 1.00 0.00 C ATOM 1244 CZ PHE A 79 -10.020 1.161 -2.765 1.00 0.00 C ATOM 0 H PHE A 79 -8.085 -2.712 0.176 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.590 -3.547 -1.142 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -7.801 -3.005 -2.237 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.182 -3.494 -3.198 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -8.170 -0.828 -0.773 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.486 -1.851 -4.198 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.823 1.526 -1.033 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.141 0.503 -4.462 1.00 0.00 H new ATOM 0 HZ PHE A 79 -10.304 2.196 -2.881 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.770 -5.891 -1.863 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.490 -7.321 -1.924 1.00 0.00 C ATOM 1256 C ASP A 80 -9.543 -7.825 -3.362 1.00 0.00 C ATOM 1257 O ASP A 80 -10.245 -7.262 -4.203 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.489 -8.095 -1.062 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.871 -7.470 -1.076 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -12.547 -7.548 -2.123 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -12.276 -6.905 -0.039 1.00 0.00 O ATOM 0 H ASP A 80 -10.502 -5.577 -2.500 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.484 -7.486 -1.538 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.554 -9.122 -1.420 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -10.123 -8.138 -0.036 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.795 -8.888 -3.640 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.755 -9.467 -4.977 1.00 0.00 C ATOM 1268 C PHE A 81 -8.505 -10.971 -4.912 1.00 0.00 C ATOM 1269 O PHE A 81 -7.467 -11.418 -4.423 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.666 -8.793 -5.815 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.562 -7.313 -5.585 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.385 -6.432 -6.269 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.642 -6.802 -4.684 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.292 -5.069 -6.059 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.545 -5.440 -4.469 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.370 -4.572 -5.159 1.00 0.00 C ATOM 0 H PHE A 81 -8.208 -9.366 -2.956 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.723 -9.298 -5.448 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.706 -9.256 -5.588 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.866 -8.975 -6.871 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.108 -6.815 -6.974 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.993 -7.475 -4.144 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -8.940 -4.393 -6.598 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.825 -5.054 -3.762 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.294 -3.507 -4.995 1.00 0.00 H new ATOM 1286 N SER A 82 -9.464 -11.746 -5.408 1.00 0.00 N ATOM 1287 CA SER A 82 -9.351 -13.200 -5.402 1.00 0.00 C ATOM 1288 C SER A 82 -8.262 -13.664 -6.365 1.00 0.00 C ATOM 1289 O SER A 82 -8.520 -13.896 -7.546 1.00 0.00 O ATOM 1290 CB SER A 82 -10.689 -13.838 -5.781 1.00 0.00 C ATOM 1291 OG SER A 82 -11.168 -13.325 -7.012 1.00 0.00 O ATOM 0 H SER A 82 -10.328 -11.392 -5.819 1.00 0.00 H new ATOM 0 HA SER A 82 -9.079 -13.515 -4.395 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.572 -14.919 -5.855 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.421 -13.650 -4.995 1.00 0.00 H new ATOM 0 HG SER A 82 -10.442 -13.322 -7.670 1.00 0.00 H new ATOM 1297 N VAL A 83 -7.044 -13.797 -5.851 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.915 -14.234 -6.664 1.00 0.00 C ATOM 1299 C VAL A 83 -4.977 -15.132 -5.864 1.00 0.00 C ATOM 1300 O VAL A 83 -4.662 -14.846 -4.709 1.00 0.00 O ATOM 1301 CB VAL A 83 -5.118 -13.034 -7.209 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.878 -12.009 -6.111 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.801 -13.500 -7.812 1.00 0.00 C ATOM 0 H VAL A 83 -6.813 -13.609 -4.875 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.327 -14.797 -7.501 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.704 -12.558 -7.995 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.314 -11.169 -6.515 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.835 -11.653 -5.730 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.313 -12.470 -5.301 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.250 -12.640 -8.192 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.208 -14.001 -7.047 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.000 -14.193 -8.629 1.00 0.00 H new ATOM 1313 N SER A 84 -4.534 -16.219 -6.487 1.00 0.00 N ATOM 1314 CA SER A 84 -3.634 -17.162 -5.833 1.00 0.00 C ATOM 1315 C SER A 84 -2.219 -16.597 -5.754 1.00 0.00 C ATOM 1316 O SER A 84 -1.731 -15.978 -6.700 1.00 0.00 O ATOM 1317 CB SER A 84 -3.622 -18.494 -6.585 1.00 0.00 C ATOM 1318 OG SER A 84 -4.934 -18.889 -6.944 1.00 0.00 O ATOM 0 H SER A 84 -4.784 -16.469 -7.444 1.00 0.00 H new ATOM 0 HA SER A 84 -3.997 -17.329 -4.819 1.00 0.00 H new ATOM 0 HB2 SER A 84 -3.008 -18.404 -7.481 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.165 -19.263 -5.962 1.00 0.00 H new ATOM 0 HG SER A 84 -4.899 -19.742 -7.425 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.565 -16.813 -4.618 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.206 -16.326 -4.412 1.00 0.00 C ATOM 1326 C LEU A 85 0.671 -16.633 -5.622 1.00 0.00 C ATOM 1327 O LEU A 85 1.396 -15.776 -6.128 1.00 0.00 O ATOM 1328 CB LEU A 85 0.399 -16.956 -3.157 1.00 0.00 C ATOM 1329 CG LEU A 85 1.915 -17.154 -3.169 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.628 -15.832 -2.931 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.327 -18.179 -2.123 1.00 0.00 C ATOM 0 H LEU A 85 -1.954 -17.323 -3.825 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.250 -15.245 -4.282 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.141 -16.332 -2.301 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.073 -17.926 -2.998 1.00 0.00 H new ATOM 0 HG LEU A 85 2.205 -17.529 -4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.706 -15.993 -2.943 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.358 -15.126 -3.716 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.332 -15.428 -1.963 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.409 -18.307 -2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.023 -17.833 -1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.844 -19.132 -2.338 1.00 0.00 H new ATOM 1343 N PRO A 86 0.604 -17.884 -6.100 1.00 0.00 N ATOM 1344 CA PRO A 86 1.383 -18.333 -7.258 1.00 0.00 C ATOM 1345 C PRO A 86 1.287 -17.364 -8.431 1.00 0.00 C ATOM 1346 O PRO A 86 2.225 -17.234 -9.217 1.00 0.00 O ATOM 1347 CB PRO A 86 0.741 -19.675 -7.618 1.00 0.00 C ATOM 1348 CG PRO A 86 0.147 -20.166 -6.343 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.239 -18.958 -5.546 1.00 0.00 C ATOM 0 HA PRO A 86 2.447 -18.401 -7.033 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.020 -19.555 -8.389 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.480 -20.376 -8.006 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.723 -20.793 -6.539 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.863 -20.777 -5.794 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.299 -18.730 -5.654 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.052 -19.105 -4.482 1.00 0.00 H new ATOM 1357 N GLU A 87 0.149 -16.687 -8.543 1.00 0.00 N ATOM 1358 CA GLU A 87 -0.068 -15.730 -9.621 1.00 0.00 C ATOM 1359 C GLU A 87 0.356 -14.327 -9.197 1.00 0.00 C ATOM 1360 O GLU A 87 0.998 -13.603 -9.959 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.539 -15.725 -10.041 1.00 0.00 C ATOM 1362 CG GLU A 87 -1.900 -16.840 -11.009 1.00 0.00 C ATOM 1363 CD GLU A 87 -3.306 -16.702 -11.560 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -4.226 -16.406 -10.770 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -3.486 -16.889 -12.782 1.00 0.00 O ATOM 0 H GLU A 87 -0.637 -16.784 -7.900 1.00 0.00 H new ATOM 0 HA GLU A 87 0.544 -16.035 -10.470 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.162 -15.812 -9.151 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.773 -14.765 -10.502 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.189 -16.843 -11.835 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.805 -17.801 -10.503 1.00 0.00 H new ATOM 1372 N VAL A 88 -0.009 -13.949 -7.976 1.00 0.00 N ATOM 1373 CA VAL A 88 0.334 -12.633 -7.449 1.00 0.00 C ATOM 1374 C VAL A 88 1.842 -12.479 -7.293 1.00 0.00 C ATOM 1375 O VAL A 88 2.357 -11.364 -7.217 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.341 -12.381 -6.088 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.518 -12.927 -4.957 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.610 -10.896 -5.894 1.00 0.00 C ATOM 0 H VAL A 88 -0.542 -14.535 -7.333 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.030 -11.899 -8.168 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.296 -12.905 -6.073 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.025 -12.740 -4.003 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.656 -14.000 -5.090 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.489 -12.433 -4.967 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.087 -10.736 -4.927 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.332 -10.348 -5.929 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.267 -10.539 -6.687 1.00 0.00 H new ATOM 1388 N GLN A 89 2.545 -13.606 -7.247 1.00 0.00 N ATOM 1389 CA GLN A 89 3.996 -13.596 -7.099 1.00 0.00 C ATOM 1390 C GLN A 89 4.662 -12.958 -8.314 1.00 0.00 C ATOM 1391 O GLN A 89 5.424 -12.000 -8.185 1.00 0.00 O ATOM 1392 CB GLN A 89 4.520 -15.020 -6.904 1.00 0.00 C ATOM 1393 CG GLN A 89 4.343 -15.544 -5.489 1.00 0.00 C ATOM 1394 CD GLN A 89 4.634 -17.028 -5.376 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.385 -17.794 -6.308 1.00 0.00 O ATOM 1396 NE2 GLN A 89 5.162 -17.443 -4.230 1.00 0.00 N ATOM 0 H GLN A 89 2.134 -14.537 -7.310 1.00 0.00 H new ATOM 0 HA GLN A 89 4.242 -13.002 -6.219 1.00 0.00 H new ATOM 0 HB2 GLN A 89 4.005 -15.686 -7.596 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.578 -15.048 -7.163 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.004 -14.996 -4.817 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.322 -15.352 -5.159 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.352 -16.774 -3.484 1.00 0.00 H new ATOM 0 HE22 GLN A 89 5.377 -18.431 -4.096 1.00 0.00 H new ATOM 1405 N ARG A 90 4.369 -13.496 -9.494 1.00 0.00 N ATOM 1406 CA ARG A 90 4.941 -12.981 -10.732 1.00 0.00 C ATOM 1407 C ARG A 90 4.296 -11.653 -11.117 1.00 0.00 C ATOM 1408 O ARG A 90 4.728 -10.992 -12.062 1.00 0.00 O ATOM 1409 CB ARG A 90 4.762 -13.995 -11.863 1.00 0.00 C ATOM 1410 CG ARG A 90 3.327 -14.117 -12.349 1.00 0.00 C ATOM 1411 CD ARG A 90 3.015 -15.532 -12.812 1.00 0.00 C ATOM 1412 NE ARG A 90 3.541 -15.799 -14.147 1.00 0.00 N ATOM 1413 CZ ARG A 90 3.168 -16.835 -14.891 1.00 0.00 C ATOM 1414 NH1 ARG A 90 2.270 -17.695 -14.431 1.00 0.00 N ATOM 1415 NH2 ARG A 90 3.692 -17.011 -16.097 1.00 0.00 N ATOM 0 H ARG A 90 3.739 -14.288 -9.618 1.00 0.00 H new ATOM 0 HA ARG A 90 6.006 -12.814 -10.569 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.397 -13.708 -12.701 1.00 0.00 H new ATOM 0 HB3 ARG A 90 5.106 -14.972 -11.522 1.00 0.00 H new ATOM 0 HG2 ARG A 90 2.645 -13.837 -11.547 1.00 0.00 H new ATOM 0 HG3 ARG A 90 3.159 -13.419 -13.169 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.439 -16.246 -12.106 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.936 -15.684 -12.810 1.00 0.00 H new ATOM 0 HE ARG A 90 4.233 -15.155 -14.530 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.864 -17.562 -13.505 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.985 -18.490 -15.003 1.00 0.00 H new ATOM 0 HH21 ARG A 90 4.382 -16.351 -16.454 1.00 0.00 H new ATOM 0 HH22 ARG A 90 3.405 -17.807 -16.667 1.00 0.00 H new ATOM 1429 N ARG A 91 3.258 -11.269 -10.380 1.00 0.00 N ATOM 1430 CA ARG A 91 2.552 -10.022 -10.646 1.00 0.00 C ATOM 1431 C ARG A 91 3.086 -8.896 -9.765 1.00 0.00 C ATOM 1432 O ARG A 91 3.913 -9.123 -8.881 1.00 0.00 O ATOM 1433 CB ARG A 91 1.051 -10.201 -10.409 1.00 0.00 C ATOM 1434 CG ARG A 91 0.344 -10.956 -11.523 1.00 0.00 C ATOM 1435 CD ARG A 91 -1.107 -11.239 -11.170 1.00 0.00 C ATOM 1436 NE ARG A 91 -1.676 -12.297 -12.001 1.00 0.00 N ATOM 1437 CZ ARG A 91 -2.883 -12.817 -11.805 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -3.644 -12.378 -10.812 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -3.330 -13.777 -12.604 1.00 0.00 N ATOM 0 H ARG A 91 2.888 -11.804 -9.594 1.00 0.00 H new ATOM 0 HA ARG A 91 2.719 -9.754 -11.689 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.901 -10.733 -9.469 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.590 -9.220 -10.297 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.389 -10.374 -12.444 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.863 -11.895 -11.714 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.176 -11.526 -10.121 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.694 -10.328 -11.290 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.116 -12.656 -12.774 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.303 -11.639 -10.196 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.570 -12.779 -10.664 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -2.747 -14.116 -13.369 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.257 -14.176 -12.453 1.00 0.00 H new ATOM 1453 N THR A 92 2.609 -7.680 -10.013 1.00 0.00 N ATOM 1454 CA THR A 92 3.039 -6.519 -9.245 1.00 0.00 C ATOM 1455 C THR A 92 1.886 -5.546 -9.028 1.00 0.00 C ATOM 1456 O THR A 92 1.017 -5.396 -9.887 1.00 0.00 O ATOM 1457 CB THR A 92 4.195 -5.780 -9.944 1.00 0.00 C ATOM 1458 OG1 THR A 92 5.285 -6.680 -10.173 1.00 0.00 O ATOM 1459 CG2 THR A 92 4.671 -4.603 -9.106 1.00 0.00 C ATOM 0 H THR A 92 1.924 -7.474 -10.740 1.00 0.00 H new ATOM 0 HA THR A 92 3.385 -6.889 -8.280 1.00 0.00 H new ATOM 0 HB THR A 92 3.830 -5.402 -10.899 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.015 -6.203 -10.619 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.488 -4.097 -9.620 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.847 -3.905 -8.958 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.020 -4.963 -8.138 1.00 0.00 H new ATOM 1467 N LEU A 93 1.885 -4.885 -7.875 1.00 0.00 N ATOM 1468 CA LEU A 93 0.838 -3.924 -7.545 1.00 0.00 C ATOM 1469 C LEU A 93 1.229 -2.519 -7.992 1.00 0.00 C ATOM 1470 O LEU A 93 2.053 -1.862 -7.357 1.00 0.00 O ATOM 1471 CB LEU A 93 0.564 -3.936 -6.041 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.854 -3.552 -5.614 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.761 -4.772 -5.619 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.839 -2.902 -4.238 1.00 0.00 C ATOM 0 H LEU A 93 2.597 -4.997 -7.153 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.069 -4.215 -8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.779 -4.935 -5.661 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.264 -3.254 -5.559 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.246 -2.830 -6.331 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.765 -4.480 -5.313 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.796 -5.195 -6.623 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.372 -5.517 -4.925 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.856 -2.635 -3.950 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.427 -3.601 -3.510 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.223 -2.003 -4.267 1.00 0.00 H new ATOM 1486 N ASP A 94 0.630 -2.064 -9.087 1.00 0.00 N ATOM 1487 CA ASP A 94 0.912 -0.735 -9.617 1.00 0.00 C ATOM 1488 C ASP A 94 0.256 0.343 -8.759 1.00 0.00 C ATOM 1489 O ASP A 94 -0.941 0.603 -8.880 1.00 0.00 O ATOM 1490 CB ASP A 94 0.422 -0.624 -11.061 1.00 0.00 C ATOM 1491 CG ASP A 94 0.373 0.811 -11.547 1.00 0.00 C ATOM 1492 OD1 ASP A 94 1.453 1.405 -11.754 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -0.744 1.341 -11.722 1.00 0.00 O ATOM 0 H ASP A 94 -0.054 -2.596 -9.625 1.00 0.00 H new ATOM 0 HA ASP A 94 1.991 -0.584 -9.596 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.080 -1.202 -11.710 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.572 -1.065 -11.139 1.00 0.00 H new ATOM 1498 N VAL A 95 1.048 0.966 -7.893 1.00 0.00 N ATOM 1499 CA VAL A 95 0.544 2.016 -7.015 1.00 0.00 C ATOM 1500 C VAL A 95 1.117 3.376 -7.400 1.00 0.00 C ATOM 1501 O VAL A 95 2.256 3.699 -7.063 1.00 0.00 O ATOM 1502 CB VAL A 95 0.884 1.726 -5.541 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.187 2.721 -4.627 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.505 0.299 -5.178 1.00 0.00 C ATOM 0 H VAL A 95 2.041 0.762 -7.780 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.539 2.035 -7.133 1.00 0.00 H new ATOM 0 HB VAL A 95 1.960 1.837 -5.405 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.439 2.501 -3.590 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.514 3.731 -4.873 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.892 2.645 -4.762 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.752 0.111 -4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.565 0.157 -5.329 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.056 -0.396 -5.812 1.00 0.00 H new ATOM 1514 N ALA A 96 0.319 4.169 -8.107 1.00 0.00 N ATOM 1515 CA ALA A 96 0.746 5.496 -8.535 1.00 0.00 C ATOM 1516 C ALA A 96 -0.124 6.581 -7.910 1.00 0.00 C ATOM 1517 O ALA A 96 -1.348 6.562 -8.041 1.00 0.00 O ATOM 1518 CB ALA A 96 0.709 5.597 -10.053 1.00 0.00 C ATOM 0 H ALA A 96 -0.626 3.916 -8.396 1.00 0.00 H new ATOM 0 HA ALA A 96 1.771 5.648 -8.196 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.030 6.593 -10.359 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.378 4.852 -10.484 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.307 5.419 -10.405 1.00 0.00 H new ATOM 1524 N VAL A 97 0.516 7.526 -7.228 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.200 8.619 -6.582 1.00 0.00 C ATOM 1526 C VAL A 97 -0.044 9.917 -7.366 1.00 0.00 C ATOM 1527 O VAL A 97 1.064 10.429 -7.528 1.00 0.00 O ATOM 1528 CB VAL A 97 0.296 8.841 -5.141 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -0.283 10.125 -4.568 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.062 7.648 -4.266 1.00 0.00 C ATOM 0 H VAL A 97 1.529 7.556 -7.109 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.252 8.336 -6.557 1.00 0.00 H new ATOM 0 HB VAL A 97 1.382 8.938 -5.159 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.079 10.264 -3.549 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.028 10.970 -5.182 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.371 10.062 -4.561 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.296 7.821 -3.251 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.144 7.519 -4.252 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.406 6.749 -4.667 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.161 10.447 -7.852 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.151 11.687 -8.619 1.00 0.00 C ATOM 1542 C LYS A 98 -2.443 12.469 -8.406 1.00 0.00 C ATOM 1543 O LYS A 98 -3.299 12.069 -7.618 1.00 0.00 O ATOM 1544 CB LYS A 98 -0.963 11.389 -10.108 1.00 0.00 C ATOM 1545 CG LYS A 98 -1.950 10.372 -10.654 1.00 0.00 C ATOM 1546 CD LYS A 98 -1.519 8.950 -10.338 1.00 0.00 C ATOM 1547 CE LYS A 98 -2.081 7.960 -11.348 1.00 0.00 C ATOM 1548 NZ LYS A 98 -1.575 8.223 -12.723 1.00 0.00 N ATOM 0 H LYS A 98 -2.086 10.036 -7.728 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.317 12.295 -8.268 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -1.062 12.317 -10.671 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.051 11.023 -10.272 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -2.937 10.557 -10.229 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -2.040 10.494 -11.733 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.431 8.891 -10.335 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.855 8.681 -9.337 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.813 6.946 -11.050 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.170 8.016 -11.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.611 7.345 -13.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.167 8.947 -13.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -0.593 8.561 -12.673 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.577 13.586 -9.114 1.00 0.00 N ATOM 1563 CA ASN A 99 -3.766 14.423 -9.003 1.00 0.00 C ATOM 1564 C ASN A 99 -4.804 14.037 -10.051 1.00 0.00 C ATOM 1565 O ASN A 99 -4.463 13.728 -11.193 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.392 15.899 -9.159 1.00 0.00 C ATOM 1567 CG ASN A 99 -2.409 16.129 -10.291 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -1.195 16.085 -10.092 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -2.931 16.377 -11.486 1.00 0.00 N ATOM 0 H ASN A 99 -1.877 13.932 -9.770 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.199 14.266 -8.015 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.294 16.483 -9.341 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.960 16.262 -8.227 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -2.319 16.541 -12.286 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -3.944 16.404 -11.605 1.00 0.00 H new ATOM 1576 N SER A 100 -6.073 14.056 -9.655 1.00 0.00 N ATOM 1577 CA SER A 100 -7.161 13.704 -10.560 1.00 0.00 C ATOM 1578 C SER A 100 -7.281 14.724 -11.688 1.00 0.00 C ATOM 1579 O SER A 100 -6.889 15.880 -11.539 1.00 0.00 O ATOM 1580 CB SER A 100 -8.482 13.618 -9.792 1.00 0.00 C ATOM 1581 OG SER A 100 -8.922 14.903 -9.388 1.00 0.00 O ATOM 0 H SER A 100 -6.373 14.311 -8.714 1.00 0.00 H new ATOM 0 HA SER A 100 -6.938 12.731 -10.997 1.00 0.00 H new ATOM 0 HB2 SER A 100 -9.241 13.151 -10.419 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.356 12.981 -8.916 1.00 0.00 H new ATOM 0 HG SER A 100 -9.901 14.917 -9.350 1.00 0.00 H new ATOM 1587 N GLY A 101 -7.827 14.285 -12.818 1.00 0.00 N ATOM 1588 CA GLY A 101 -7.989 15.171 -13.956 1.00 0.00 C ATOM 1589 C GLY A 101 -9.440 15.530 -14.209 1.00 0.00 C ATOM 1590 O GLY A 101 -9.928 16.549 -13.721 1.00 0.00 O ATOM 0 H GLY A 101 -8.160 13.332 -12.966 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -7.416 16.083 -13.787 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -7.575 14.695 -14.845 1.00 0.00 H new ATOM 1594 N GLY A 102 -10.131 14.692 -14.976 1.00 0.00 N ATOM 1595 CA GLY A 102 -11.527 14.946 -15.281 1.00 0.00 C ATOM 1596 C GLY A 102 -11.819 14.869 -16.767 1.00 0.00 C ATOM 1597 O GLY A 102 -11.396 13.931 -17.442 1.00 0.00 O ATOM 0 H GLY A 102 -9.749 13.842 -15.391 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.148 14.222 -14.754 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.803 15.933 -14.910 1.00 0.00 H new ATOM 1601 N PHE A 103 -12.545 15.858 -17.277 1.00 0.00 N ATOM 1602 CA PHE A 103 -12.896 15.897 -18.692 1.00 0.00 C ATOM 1603 C PHE A 103 -12.582 17.264 -19.292 1.00 0.00 C ATOM 1604 O PHE A 103 -13.082 17.616 -20.362 1.00 0.00 O ATOM 1605 CB PHE A 103 -14.380 15.574 -18.880 1.00 0.00 C ATOM 1606 CG PHE A 103 -15.295 16.679 -18.435 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -15.474 16.948 -17.087 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -15.978 17.448 -19.364 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -16.315 17.964 -16.674 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -16.820 18.465 -18.957 1.00 0.00 C ATOM 1611 CZ PHE A 103 -16.990 18.723 -17.610 1.00 0.00 C ATOM 0 H PHE A 103 -12.902 16.643 -16.732 1.00 0.00 H new ATOM 0 HA PHE A 103 -12.299 15.146 -19.210 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -14.567 15.360 -19.932 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -14.620 14.668 -18.323 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -14.950 16.357 -16.351 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -15.851 17.250 -20.418 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -16.444 18.164 -15.621 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -17.345 19.058 -19.691 1.00 0.00 H new ATOM 0 HZ PHE A 103 -17.649 19.516 -17.290 1.00 0.00 H new ATOM 1621 N LEU A 104 -11.750 18.032 -18.596 1.00 0.00 N ATOM 1622 CA LEU A 104 -11.368 19.362 -19.059 1.00 0.00 C ATOM 1623 C LEU A 104 -10.009 19.328 -19.751 1.00 0.00 C ATOM 1624 O LEU A 104 -9.768 20.070 -20.703 1.00 0.00 O ATOM 1625 CB LEU A 104 -11.331 20.341 -17.884 1.00 0.00 C ATOM 1626 CG LEU A 104 -12.510 20.271 -16.914 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -12.118 20.831 -15.556 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -13.709 21.022 -17.477 1.00 0.00 C ATOM 0 H LEU A 104 -11.327 17.757 -17.709 1.00 0.00 H new ATOM 0 HA LEU A 104 -12.114 19.697 -19.780 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -10.413 20.168 -17.322 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -11.274 21.354 -18.283 1.00 0.00 H new ATOM 0 HG LEU A 104 -12.789 19.225 -16.786 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -12.970 20.773 -14.879 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -11.290 20.251 -15.148 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -11.812 21.871 -15.666 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -14.539 20.962 -16.773 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -13.442 22.067 -17.635 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -14.005 20.576 -18.426 1.00 0.00 H new ATOM 1640 N SER A 105 -9.127 18.459 -19.268 1.00 0.00 N ATOM 1641 CA SER A 105 -7.791 18.329 -19.839 1.00 0.00 C ATOM 1642 C SER A 105 -7.556 16.913 -20.355 1.00 0.00 C ATOM 1643 O SER A 105 -8.462 16.078 -20.347 1.00 0.00 O ATOM 1644 CB SER A 105 -6.730 18.687 -18.797 1.00 0.00 C ATOM 1645 OG SER A 105 -6.876 20.028 -18.361 1.00 0.00 O ATOM 0 H SER A 105 -9.313 17.835 -18.483 1.00 0.00 H new ATOM 0 HA SER A 105 -7.713 19.020 -20.678 1.00 0.00 H new ATOM 0 HB2 SER A 105 -6.811 18.013 -17.944 1.00 0.00 H new ATOM 0 HB3 SER A 105 -5.736 18.545 -19.222 1.00 0.00 H new ATOM 0 HG SER A 105 -6.187 20.232 -17.694 1.00 0.00 H new ATOM 1651 N LYS A 106 -6.334 16.648 -20.802 1.00 0.00 N ATOM 1652 CA LYS A 106 -5.976 15.333 -21.321 1.00 0.00 C ATOM 1653 C LYS A 106 -4.695 14.821 -20.670 1.00 0.00 C ATOM 1654 O LYS A 106 -4.264 13.697 -20.927 1.00 0.00 O ATOM 1655 CB LYS A 106 -5.801 15.391 -22.840 1.00 0.00 C ATOM 1656 CG LYS A 106 -5.109 16.654 -23.325 1.00 0.00 C ATOM 1657 CD LYS A 106 -3.599 16.490 -23.341 1.00 0.00 C ATOM 1658 CE LYS A 106 -3.129 15.783 -24.603 1.00 0.00 C ATOM 1659 NZ LYS A 106 -2.914 16.737 -25.726 1.00 0.00 N ATOM 0 H LYS A 106 -5.573 17.327 -20.816 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.785 14.643 -21.081 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -5.225 14.524 -23.164 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -6.780 15.319 -23.313 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.460 16.901 -24.327 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -5.379 17.489 -22.678 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -3.125 17.469 -23.273 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.284 15.922 -22.466 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -2.201 15.250 -24.396 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.867 15.036 -24.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.594 16.216 -26.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -3.806 17.227 -25.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -2.192 17.435 -25.455 1.00 0.00 H new ATOM 1673 N ASP A 107 -4.093 15.652 -19.826 1.00 0.00 N ATOM 1674 CA ASP A 107 -2.863 15.282 -19.137 1.00 0.00 C ATOM 1675 C ASP A 107 -3.163 14.742 -17.742 1.00 0.00 C ATOM 1676 O ASP A 107 -4.164 15.106 -17.125 1.00 0.00 O ATOM 1677 CB ASP A 107 -1.925 16.487 -19.040 1.00 0.00 C ATOM 1678 CG ASP A 107 -0.805 16.270 -18.041 1.00 0.00 C ATOM 1679 OD1 ASP A 107 -1.069 16.364 -16.824 1.00 0.00 O ATOM 1680 OD2 ASP A 107 0.335 16.006 -18.477 1.00 0.00 O ATOM 0 H ASP A 107 -4.437 16.586 -19.603 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.375 14.497 -19.714 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.498 16.691 -20.022 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -2.499 17.368 -18.753 1.00 0.00 H new ATOM 1685 N LYS A 108 -2.289 13.871 -17.250 1.00 0.00 N ATOM 1686 CA LYS A 108 -2.458 13.279 -15.928 1.00 0.00 C ATOM 1687 C LYS A 108 -1.406 13.805 -14.958 1.00 0.00 C ATOM 1688 O LYS A 108 -1.647 13.898 -13.755 1.00 0.00 O ATOM 1689 CB LYS A 108 -2.372 11.754 -16.014 1.00 0.00 C ATOM 1690 CG LYS A 108 -3.353 11.143 -17.000 1.00 0.00 C ATOM 1691 CD LYS A 108 -2.750 11.032 -18.390 1.00 0.00 C ATOM 1692 CE LYS A 108 -3.691 10.321 -19.350 1.00 0.00 C ATOM 1693 NZ LYS A 108 -4.693 11.253 -19.938 1.00 0.00 N ATOM 0 H LYS A 108 -1.455 13.559 -17.748 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.443 13.560 -15.555 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -1.359 11.471 -16.300 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -2.553 11.332 -15.025 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -3.652 10.154 -16.652 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -4.256 11.753 -17.042 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.525 12.028 -18.771 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -1.806 10.490 -18.336 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -3.112 9.858 -20.150 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -4.207 9.518 -18.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -5.058 10.855 -20.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -5.479 11.385 -19.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -4.243 12.171 -20.129 1.00 0.00 H new ATOM 1707 N GLY A 109 -0.236 14.148 -15.489 1.00 0.00 N ATOM 1708 CA GLY A 109 0.835 14.662 -14.655 1.00 0.00 C ATOM 1709 C GLY A 109 1.033 13.842 -13.396 1.00 0.00 C ATOM 1710 O GLY A 109 0.521 14.192 -12.332 1.00 0.00 O ATOM 0 H GLY A 109 -0.011 14.079 -16.481 1.00 0.00 H new ATOM 0 HA2 GLY A 109 1.763 14.674 -15.227 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.615 15.694 -14.382 1.00 0.00 H new ATOM 1714 N LEU A 110 1.777 12.748 -13.515 1.00 0.00 N ATOM 1715 CA LEU A 110 2.040 11.874 -12.377 1.00 0.00 C ATOM 1716 C LEU A 110 2.907 12.580 -11.338 1.00 0.00 C ATOM 1717 O LEU A 110 3.970 13.112 -11.659 1.00 0.00 O ATOM 1718 CB LEU A 110 2.727 10.590 -12.843 1.00 0.00 C ATOM 1719 CG LEU A 110 3.364 9.733 -11.747 1.00 0.00 C ATOM 1720 CD1 LEU A 110 2.343 8.770 -11.162 1.00 0.00 C ATOM 1721 CD2 LEU A 110 4.564 8.974 -12.294 1.00 0.00 C ATOM 0 H LEU A 110 2.209 12.445 -14.388 1.00 0.00 H new ATOM 0 HA LEU A 110 1.085 11.621 -11.916 1.00 0.00 H new ATOM 0 HB2 LEU A 110 1.994 9.981 -13.372 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.500 10.856 -13.564 1.00 0.00 H new ATOM 0 HG LEU A 110 3.709 10.392 -10.951 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.814 8.169 -10.384 1.00 0.00 H new ATOM 0 HD12 LEU A 110 1.515 9.334 -10.733 1.00 0.00 H new ATOM 0 HD13 LEU A 110 1.967 8.116 -11.949 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.005 8.370 -11.501 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.243 8.325 -13.109 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.305 9.683 -12.664 1.00 0.00 H new ATOM 1733 N LEU A 111 2.447 12.578 -10.092 1.00 0.00 N ATOM 1734 CA LEU A 111 3.181 13.216 -9.004 1.00 0.00 C ATOM 1735 C LEU A 111 4.172 12.243 -8.373 1.00 0.00 C ATOM 1736 O LEU A 111 5.228 12.646 -7.887 1.00 0.00 O ATOM 1737 CB LEU A 111 2.210 13.733 -7.942 1.00 0.00 C ATOM 1738 CG LEU A 111 1.103 14.663 -8.441 1.00 0.00 C ATOM 1739 CD1 LEU A 111 0.079 14.910 -7.344 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.691 15.978 -8.930 1.00 0.00 C ATOM 0 H LEU A 111 1.569 12.142 -9.810 1.00 0.00 H new ATOM 0 HA LEU A 111 3.738 14.057 -9.418 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.745 12.876 -7.455 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.784 14.260 -7.180 1.00 0.00 H new ATOM 0 HG LEU A 111 0.599 14.180 -9.278 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.701 15.574 -7.717 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.366 13.962 -7.041 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.569 15.372 -6.486 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.889 16.627 -9.281 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.221 16.466 -8.112 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.385 15.784 -9.748 1.00 0.00 H new ATOM 1752 N GLY A 112 3.825 10.960 -8.386 1.00 0.00 N ATOM 1753 CA GLY A 112 4.695 9.950 -7.813 1.00 0.00 C ATOM 1754 C GLY A 112 4.138 8.549 -7.967 1.00 0.00 C ATOM 1755 O GLY A 112 2.922 8.352 -7.963 1.00 0.00 O ATOM 0 H GLY A 112 2.957 10.602 -8.783 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.673 10.003 -8.292 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.846 10.163 -6.755 1.00 0.00 H new ATOM 1759 N LYS A 113 5.027 7.572 -8.106 1.00 0.00 N ATOM 1760 CA LYS A 113 4.619 6.181 -8.263 1.00 0.00 C ATOM 1761 C LYS A 113 5.679 5.236 -7.707 1.00 0.00 C ATOM 1762 O LYS A 113 6.874 5.531 -7.754 1.00 0.00 O ATOM 1763 CB LYS A 113 4.363 5.866 -9.738 1.00 0.00 C ATOM 1764 CG LYS A 113 5.623 5.858 -10.586 1.00 0.00 C ATOM 1765 CD LYS A 113 5.343 5.369 -11.997 1.00 0.00 C ATOM 1766 CE LYS A 113 5.378 3.850 -12.078 1.00 0.00 C ATOM 1767 NZ LYS A 113 6.772 3.326 -12.069 1.00 0.00 N ATOM 0 H LYS A 113 6.036 7.718 -8.113 1.00 0.00 H new ATOM 0 HA LYS A 113 3.697 6.034 -7.701 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.878 4.893 -9.814 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.668 6.601 -10.143 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.043 6.863 -10.625 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.372 5.218 -10.120 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.367 5.729 -12.321 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.081 5.788 -12.681 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.826 3.429 -11.238 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.873 3.523 -12.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.764 2.315 -12.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 7.342 3.845 -12.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.184 3.452 -11.123 1.00 0.00 H new ATOM 1781 N VAL A 114 5.236 4.098 -7.183 1.00 0.00 N ATOM 1782 CA VAL A 114 6.147 3.109 -6.620 1.00 0.00 C ATOM 1783 C VAL A 114 5.611 1.695 -6.814 1.00 0.00 C ATOM 1784 O VAL A 114 4.461 1.404 -6.482 1.00 0.00 O ATOM 1785 CB VAL A 114 6.386 3.354 -5.119 1.00 0.00 C ATOM 1786 CG1 VAL A 114 5.084 3.224 -4.343 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.435 2.393 -4.582 1.00 0.00 C ATOM 0 H VAL A 114 4.251 3.838 -7.137 1.00 0.00 H new ATOM 0 HA VAL A 114 7.093 3.213 -7.152 1.00 0.00 H new ATOM 0 HB VAL A 114 6.758 4.370 -4.989 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.272 3.400 -3.284 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.366 3.957 -4.711 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.679 2.221 -4.477 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.591 2.581 -3.520 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.095 1.367 -4.723 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.372 2.541 -5.118 1.00 0.00 H new ATOM 1797 N LEU A 115 6.451 0.818 -7.353 1.00 0.00 N ATOM 1798 CA LEU A 115 6.063 -0.568 -7.591 1.00 0.00 C ATOM 1799 C LEU A 115 6.465 -1.455 -6.417 1.00 0.00 C ATOM 1800 O LEU A 115 7.509 -1.249 -5.799 1.00 0.00 O ATOM 1801 CB LEU A 115 6.705 -1.084 -8.879 1.00 0.00 C ATOM 1802 CG LEU A 115 5.965 -0.756 -10.176 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.609 -1.443 -10.206 1.00 0.00 C ATOM 1804 CD2 LEU A 115 5.807 0.749 -10.334 1.00 0.00 C ATOM 0 H LEU A 115 7.406 1.042 -7.634 1.00 0.00 H new ATOM 0 HA LEU A 115 4.978 -0.603 -7.694 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.714 -0.677 -8.947 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.803 -2.167 -8.804 1.00 0.00 H new ATOM 0 HG LEU A 115 6.556 -1.129 -11.013 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.097 -1.198 -11.137 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.746 -2.522 -10.141 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.010 -1.102 -9.362 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.278 0.964 -11.263 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.239 1.145 -9.493 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.791 1.217 -10.360 1.00 0.00 H new ATOM 1816 N VAL A 116 5.630 -2.445 -6.117 1.00 0.00 N ATOM 1817 CA VAL A 116 5.899 -3.366 -5.019 1.00 0.00 C ATOM 1818 C VAL A 116 5.886 -4.813 -5.501 1.00 0.00 C ATOM 1819 O VAL A 116 4.872 -5.303 -5.996 1.00 0.00 O ATOM 1820 CB VAL A 116 4.870 -3.205 -3.885 1.00 0.00 C ATOM 1821 CG1 VAL A 116 5.149 -4.197 -2.766 1.00 0.00 C ATOM 1822 CG2 VAL A 116 4.879 -1.778 -3.357 1.00 0.00 C ATOM 0 H VAL A 116 4.762 -2.630 -6.619 1.00 0.00 H new ATOM 0 HA VAL A 116 6.890 -3.121 -4.636 1.00 0.00 H new ATOM 0 HB VAL A 116 3.878 -3.415 -4.285 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.412 -4.068 -1.974 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.088 -5.213 -3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.147 -4.022 -2.365 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.146 -1.682 -2.556 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.870 -1.539 -2.972 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.627 -1.090 -4.164 1.00 0.00 H new ATOM 1832 N ALA A 117 7.019 -5.491 -5.352 1.00 0.00 N ATOM 1833 CA ALA A 117 7.137 -6.882 -5.769 1.00 0.00 C ATOM 1834 C ALA A 117 6.485 -7.816 -4.756 1.00 0.00 C ATOM 1835 O ALA A 117 7.003 -8.017 -3.657 1.00 0.00 O ATOM 1836 CB ALA A 117 8.600 -7.252 -5.965 1.00 0.00 C ATOM 0 H ALA A 117 7.868 -5.099 -4.945 1.00 0.00 H new ATOM 0 HA ALA A 117 6.614 -6.996 -6.719 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.673 -8.294 -6.276 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.037 -6.613 -6.732 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.139 -7.115 -5.027 1.00 0.00 H new ATOM 1842 N LEU A 118 5.344 -8.385 -5.131 1.00 0.00 N ATOM 1843 CA LEU A 118 4.620 -9.298 -4.255 1.00 0.00 C ATOM 1844 C LEU A 118 5.173 -10.715 -4.368 1.00 0.00 C ATOM 1845 O LEU A 118 4.471 -11.689 -4.097 1.00 0.00 O ATOM 1846 CB LEU A 118 3.129 -9.291 -4.598 1.00 0.00 C ATOM 1847 CG LEU A 118 2.542 -7.941 -5.011 1.00 0.00 C ATOM 1848 CD1 LEU A 118 1.168 -8.126 -5.637 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.463 -7.005 -3.814 1.00 0.00 C ATOM 0 H LEU A 118 4.901 -8.230 -6.036 1.00 0.00 H new ATOM 0 HA LEU A 118 4.752 -8.957 -3.228 1.00 0.00 H new ATOM 0 HB2 LEU A 118 2.959 -10.001 -5.407 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.576 -9.656 -3.733 1.00 0.00 H new ATOM 0 HG LEU A 118 3.200 -7.492 -5.755 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.766 -7.155 -5.925 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.253 -8.760 -6.520 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.500 -8.596 -4.916 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.043 -6.049 -4.127 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.827 -7.448 -3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.463 -6.847 -3.409 1.00 0.00 H new ATOM 1861 N ALA A 119 6.435 -10.822 -4.768 1.00 0.00 N ATOM 1862 CA ALA A 119 7.084 -12.120 -4.913 1.00 0.00 C ATOM 1863 C ALA A 119 7.645 -12.604 -3.580 1.00 0.00 C ATOM 1864 O ALA A 119 8.577 -13.408 -3.544 1.00 0.00 O ATOM 1865 CB ALA A 119 8.188 -12.044 -5.957 1.00 0.00 C ATOM 0 H ALA A 119 7.029 -10.025 -4.998 1.00 0.00 H new ATOM 0 HA ALA A 119 6.335 -12.839 -5.245 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.664 -13.020 -6.055 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.762 -11.750 -6.916 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.930 -11.308 -5.649 1.00 0.00 H new ATOM 1871 N SER A 120 7.073 -12.110 -2.487 1.00 0.00 N ATOM 1872 CA SER A 120 7.520 -12.489 -1.152 1.00 0.00 C ATOM 1873 C SER A 120 6.835 -13.773 -0.694 1.00 0.00 C ATOM 1874 O SER A 120 6.010 -14.337 -1.411 1.00 0.00 O ATOM 1875 CB SER A 120 7.236 -11.363 -0.157 1.00 0.00 C ATOM 1876 OG SER A 120 7.676 -11.709 1.145 1.00 0.00 O ATOM 0 H SER A 120 6.299 -11.446 -2.500 1.00 0.00 H new ATOM 0 HA SER A 120 8.595 -12.666 -1.192 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.736 -10.451 -0.483 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.167 -11.151 -0.139 1.00 0.00 H new ATOM 0 HG SER A 120 8.624 -11.956 1.115 1.00 0.00 H new ATOM 1882 N GLU A 121 7.185 -14.228 0.505 1.00 0.00 N ATOM 1883 CA GLU A 121 6.605 -15.446 1.058 1.00 0.00 C ATOM 1884 C GLU A 121 5.968 -15.176 2.418 1.00 0.00 C ATOM 1885 O GLU A 121 5.112 -15.932 2.875 1.00 0.00 O ATOM 1886 CB GLU A 121 7.674 -16.533 1.190 1.00 0.00 C ATOM 1887 CG GLU A 121 8.894 -16.094 1.982 1.00 0.00 C ATOM 1888 CD GLU A 121 9.854 -17.235 2.255 1.00 0.00 C ATOM 1889 OE1 GLU A 121 9.469 -18.174 2.983 1.00 0.00 O ATOM 1890 OE2 GLU A 121 10.991 -17.190 1.740 1.00 0.00 O ATOM 0 H GLU A 121 7.867 -13.772 1.111 1.00 0.00 H new ATOM 0 HA GLU A 121 5.829 -15.791 0.374 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.234 -17.407 1.671 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.990 -16.843 0.194 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.415 -15.309 1.434 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.571 -15.661 2.929 1.00 0.00 H new ATOM 1897 N GLU A 122 6.395 -14.093 3.060 1.00 0.00 N ATOM 1898 CA GLU A 122 5.868 -13.724 4.369 1.00 0.00 C ATOM 1899 C GLU A 122 4.559 -12.952 4.230 1.00 0.00 C ATOM 1900 O GLU A 122 4.119 -12.280 5.164 1.00 0.00 O ATOM 1901 CB GLU A 122 6.890 -12.883 5.136 1.00 0.00 C ATOM 1902 CG GLU A 122 8.082 -13.681 5.637 1.00 0.00 C ATOM 1903 CD GLU A 122 7.745 -14.540 6.840 1.00 0.00 C ATOM 1904 OE1 GLU A 122 7.176 -15.635 6.647 1.00 0.00 O ATOM 1905 OE2 GLU A 122 8.050 -14.117 7.975 1.00 0.00 O ATOM 0 H GLU A 122 7.104 -13.456 2.695 1.00 0.00 H new ATOM 0 HA GLU A 122 5.672 -14.641 4.925 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.246 -12.081 4.490 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.396 -12.412 5.986 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.452 -14.317 4.833 1.00 0.00 H new ATOM 0 HG3 GLU A 122 8.889 -12.996 5.899 1.00 0.00 H new ATOM 1912 N LEU A 123 3.941 -13.051 3.058 1.00 0.00 N ATOM 1913 CA LEU A 123 2.683 -12.363 2.795 1.00 0.00 C ATOM 1914 C LEU A 123 1.601 -12.812 3.773 1.00 0.00 C ATOM 1915 O LEU A 123 0.901 -11.988 4.361 1.00 0.00 O ATOM 1916 CB LEU A 123 2.227 -12.622 1.358 1.00 0.00 C ATOM 1917 CG LEU A 123 2.754 -11.652 0.301 1.00 0.00 C ATOM 1918 CD1 LEU A 123 2.656 -12.268 -1.086 1.00 0.00 C ATOM 1919 CD2 LEU A 123 1.992 -10.336 0.357 1.00 0.00 C ATOM 0 H LEU A 123 4.292 -13.602 2.274 1.00 0.00 H new ATOM 0 HA LEU A 123 2.848 -11.294 2.930 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.529 -13.631 1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.138 -12.597 1.334 1.00 0.00 H new ATOM 0 HG LEU A 123 3.804 -11.450 0.513 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.036 -11.563 -1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.247 -13.183 -1.120 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.615 -12.501 -1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.381 -9.658 -0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.934 -10.520 0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.115 -9.886 1.342 1.00 0.00 H new ATOM 1931 N ALA A 124 1.473 -14.124 3.942 1.00 0.00 N ATOM 1932 CA ALA A 124 0.480 -14.683 4.852 1.00 0.00 C ATOM 1933 C ALA A 124 0.471 -13.936 6.181 1.00 0.00 C ATOM 1934 O ALA A 124 -0.574 -13.783 6.813 1.00 0.00 O ATOM 1935 CB ALA A 124 0.746 -16.164 5.078 1.00 0.00 C ATOM 0 H ALA A 124 2.044 -14.819 3.461 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.502 -14.567 4.394 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -0.003 -16.568 5.759 1.00 0.00 H new ATOM 0 HB2 ALA A 124 0.694 -16.692 4.126 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.738 -16.294 5.511 1.00 0.00 H new ATOM 1941 N LYS A 125 1.644 -13.472 6.602 1.00 0.00 N ATOM 1942 CA LYS A 125 1.772 -12.740 7.856 1.00 0.00 C ATOM 1943 C LYS A 125 1.432 -11.266 7.663 1.00 0.00 C ATOM 1944 O LYS A 125 0.954 -10.603 8.583 1.00 0.00 O ATOM 1945 CB LYS A 125 3.192 -12.879 8.409 1.00 0.00 C ATOM 1946 CG LYS A 125 3.749 -14.289 8.309 1.00 0.00 C ATOM 1947 CD LYS A 125 3.075 -15.226 9.297 1.00 0.00 C ATOM 1948 CE LYS A 125 3.641 -15.058 10.699 1.00 0.00 C ATOM 1949 NZ LYS A 125 2.628 -15.367 11.746 1.00 0.00 N ATOM 0 H LYS A 125 2.519 -13.591 6.092 1.00 0.00 H new ATOM 0 HA LYS A 125 1.067 -13.166 8.570 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.851 -12.198 7.870 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.198 -12.568 9.454 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.609 -14.665 7.296 1.00 0.00 H new ATOM 0 HG3 LYS A 125 4.822 -14.271 8.497 1.00 0.00 H new ATOM 0 HD2 LYS A 125 2.003 -15.032 9.311 1.00 0.00 H new ATOM 0 HD3 LYS A 125 3.208 -16.258 8.971 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.503 -15.713 10.823 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.996 -14.035 10.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.052 -15.241 12.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 1.816 -14.726 11.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.308 -16.351 11.640 1.00 0.00 H new ATOM 1963 N GLY A 126 1.681 -10.758 6.459 1.00 0.00 N ATOM 1964 CA GLY A 126 1.394 -9.366 6.168 1.00 0.00 C ATOM 1965 C GLY A 126 2.387 -8.421 6.815 1.00 0.00 C ATOM 1966 O GLY A 126 2.950 -8.727 7.866 1.00 0.00 O ATOM 0 H GLY A 126 2.076 -11.286 5.681 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.403 -9.214 5.089 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.389 -9.125 6.515 1.00 0.00 H new ATOM 1970 N TRP A 127 2.603 -7.272 6.186 1.00 0.00 N ATOM 1971 CA TRP A 127 3.537 -6.280 6.707 1.00 0.00 C ATOM 1972 C TRP A 127 3.085 -4.867 6.353 1.00 0.00 C ATOM 1973 O TRP A 127 2.216 -4.678 5.501 1.00 0.00 O ATOM 1974 CB TRP A 127 4.941 -6.532 6.157 1.00 0.00 C ATOM 1975 CG TRP A 127 5.087 -6.166 4.711 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.403 -4.937 4.205 1.00 0.00 C ATOM 1977 CD2 TRP A 127 4.920 -7.035 3.585 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.443 -4.990 2.832 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.151 -6.266 2.428 1.00 0.00 C ATOM 1980 CE3 TRP A 127 4.601 -8.388 3.443 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.071 -6.807 1.147 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.521 -8.923 2.171 1.00 0.00 C ATOM 1983 CH2 TRP A 127 4.756 -8.134 1.037 1.00 0.00 C ATOM 0 H TRP A 127 2.145 -7.004 5.315 1.00 0.00 H new ATOM 0 HA TRP A 127 3.558 -6.373 7.793 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.661 -5.961 6.743 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.190 -7.586 6.285 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.593 -4.054 4.797 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.656 -4.207 2.214 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.420 -9.004 4.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.251 -6.201 0.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.273 -9.967 2.049 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.687 -8.582 0.057 1.00 0.00 H new ATOM 1994 N THR A 128 3.679 -3.877 7.011 1.00 0.00 N ATOM 1995 CA THR A 128 3.336 -2.482 6.766 1.00 0.00 C ATOM 1996 C THR A 128 4.588 -1.619 6.661 1.00 0.00 C ATOM 1997 O THR A 128 5.468 -1.680 7.518 1.00 0.00 O ATOM 1998 CB THR A 128 2.432 -1.921 7.880 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.219 -2.679 7.954 1.00 0.00 O ATOM 2000 CG2 THR A 128 2.107 -0.457 7.627 1.00 0.00 C ATOM 0 H THR A 128 4.401 -4.016 7.718 1.00 0.00 H new ATOM 0 HA THR A 128 2.795 -2.451 5.820 1.00 0.00 H new ATOM 0 HB THR A 128 2.967 -1.999 8.826 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.553 -2.290 7.349 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.468 -0.083 8.427 1.00 0.00 H new ATOM 0 HG22 THR A 128 3.031 0.121 7.600 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.590 -0.359 6.673 1.00 0.00 H new ATOM 2008 N GLN A 129 4.660 -0.816 5.604 1.00 0.00 N ATOM 2009 CA GLN A 129 5.806 0.060 5.388 1.00 0.00 C ATOM 2010 C GLN A 129 5.459 1.178 4.409 1.00 0.00 C ATOM 2011 O GLN A 129 4.546 1.042 3.595 1.00 0.00 O ATOM 2012 CB GLN A 129 6.997 -0.743 4.862 1.00 0.00 C ATOM 2013 CG GLN A 129 6.827 -1.214 3.427 1.00 0.00 C ATOM 2014 CD GLN A 129 7.871 -2.235 3.020 1.00 0.00 C ATOM 2015 OE1 GLN A 129 7.755 -3.419 3.337 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.900 -1.781 2.314 1.00 0.00 N ATOM 0 H GLN A 129 3.939 -0.754 4.885 1.00 0.00 H new ATOM 0 HA GLN A 129 6.074 0.509 6.344 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.896 -0.131 4.930 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.152 -1.610 5.504 1.00 0.00 H new ATOM 0 HG2 GLN A 129 5.834 -1.647 3.306 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.884 -0.356 2.758 1.00 0.00 H new ATOM 0 HE21 GLN A 129 8.956 -0.791 2.073 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.634 -2.422 2.013 1.00 0.00 H new ATOM 2025 N TRP A 130 6.194 2.281 4.495 1.00 0.00 N ATOM 2026 CA TRP A 130 5.964 3.423 3.617 1.00 0.00 C ATOM 2027 C TRP A 130 6.790 3.304 2.342 1.00 0.00 C ATOM 2028 O TRP A 130 8.020 3.314 2.385 1.00 0.00 O ATOM 2029 CB TRP A 130 6.305 4.726 4.341 1.00 0.00 C ATOM 2030 CG TRP A 130 5.321 5.085 5.414 1.00 0.00 C ATOM 2031 CD1 TRP A 130 5.345 4.678 6.717 1.00 0.00 C ATOM 2032 CD2 TRP A 130 4.168 5.922 5.274 1.00 0.00 C ATOM 2033 NE1 TRP A 130 4.276 5.212 7.396 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.540 5.979 6.533 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.607 6.630 4.208 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 2.378 6.715 6.752 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.454 7.360 4.427 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.850 7.399 5.691 1.00 0.00 C ATOM 0 H TRP A 130 6.954 2.409 5.163 1.00 0.00 H new ATOM 0 HA TRP A 130 4.909 3.433 3.344 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.298 4.639 4.783 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.350 5.536 3.613 1.00 0.00 H new ATOM 0 HD1 TRP A 130 6.094 4.032 7.150 1.00 0.00 H new ATOM 0 HE1 TRP A 130 4.065 5.061 8.383 1.00 0.00 H new ATOM 0 HE3 TRP A 130 4.066 6.607 3.231 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.910 6.745 7.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 2.011 7.910 3.610 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.950 7.980 5.830 1.00 0.00 H new ATOM 2049 N TYR A 131 6.107 3.191 1.208 1.00 0.00 N ATOM 2050 CA TYR A 131 6.779 3.068 -0.080 1.00 0.00 C ATOM 2051 C TYR A 131 7.055 4.442 -0.685 1.00 0.00 C ATOM 2052 O TYR A 131 6.169 5.062 -1.274 1.00 0.00 O ATOM 2053 CB TYR A 131 5.932 2.236 -1.044 1.00 0.00 C ATOM 2054 CG TYR A 131 5.646 0.837 -0.545 1.00 0.00 C ATOM 2055 CD1 TYR A 131 6.677 -0.002 -0.140 1.00 0.00 C ATOM 2056 CD2 TYR A 131 4.345 0.355 -0.478 1.00 0.00 C ATOM 2057 CE1 TYR A 131 6.420 -1.280 0.316 1.00 0.00 C ATOM 2058 CE2 TYR A 131 4.078 -0.922 -0.022 1.00 0.00 C ATOM 2059 CZ TYR A 131 5.119 -1.736 0.373 1.00 0.00 C ATOM 2060 OH TYR A 131 4.859 -3.008 0.828 1.00 0.00 O ATOM 0 H TYR A 131 5.088 3.182 1.155 1.00 0.00 H new ATOM 0 HA TYR A 131 7.732 2.565 0.084 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.987 2.750 -1.221 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.445 2.173 -2.004 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.697 0.351 -0.183 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.528 0.989 -0.788 1.00 0.00 H new ATOM 0 HE1 TYR A 131 7.233 -1.919 0.626 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.060 -1.280 0.025 1.00 0.00 H new ATOM 0 HH TYR A 131 3.893 -3.172 0.806 1.00 0.00 H new ATOM 2070 N ASP A 132 8.289 4.910 -0.534 1.00 0.00 N ATOM 2071 CA ASP A 132 8.683 6.210 -1.066 1.00 0.00 C ATOM 2072 C ASP A 132 8.376 6.303 -2.557 1.00 0.00 C ATOM 2073 O ASP A 132 8.810 5.462 -3.345 1.00 0.00 O ATOM 2074 CB ASP A 132 10.174 6.452 -0.824 1.00 0.00 C ATOM 2075 CG ASP A 132 11.047 5.417 -1.506 1.00 0.00 C ATOM 2076 OD1 ASP A 132 11.249 4.333 -0.921 1.00 0.00 O ATOM 2077 OD2 ASP A 132 11.529 5.692 -2.625 1.00 0.00 O ATOM 0 H ASP A 132 9.033 4.409 -0.048 1.00 0.00 H new ATOM 0 HA ASP A 132 8.108 6.977 -0.547 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.442 7.444 -1.187 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.372 6.440 0.248 1.00 0.00 H new ATOM 2082 N LEU A 133 7.623 7.329 -2.937 1.00 0.00 N ATOM 2083 CA LEU A 133 7.256 7.532 -4.335 1.00 0.00 C ATOM 2084 C LEU A 133 8.447 8.035 -5.143 1.00 0.00 C ATOM 2085 O LEU A 133 9.245 8.840 -4.661 1.00 0.00 O ATOM 2086 CB LEU A 133 6.098 8.527 -4.439 1.00 0.00 C ATOM 2087 CG LEU A 133 4.758 8.059 -3.871 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.867 9.250 -3.555 1.00 0.00 C ATOM 2089 CD2 LEU A 133 4.066 7.116 -4.845 1.00 0.00 C ATOM 0 H LEU A 133 7.255 8.033 -2.298 1.00 0.00 H new ATOM 0 HA LEU A 133 6.941 6.573 -4.746 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.387 9.445 -3.926 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.956 8.780 -5.490 1.00 0.00 H new ATOM 0 HG LEU A 133 4.947 7.517 -2.944 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.918 8.897 -3.152 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.359 9.888 -2.820 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.685 9.820 -4.466 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.114 6.793 -4.424 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.889 7.633 -5.788 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.699 6.246 -5.021 1.00 0.00 H new ATOM 2101 N THR A 134 8.562 7.556 -6.378 1.00 0.00 N ATOM 2102 CA THR A 134 9.655 7.957 -7.255 1.00 0.00 C ATOM 2103 C THR A 134 9.128 8.499 -8.579 1.00 0.00 C ATOM 2104 O THR A 134 7.918 8.561 -8.796 1.00 0.00 O ATOM 2105 CB THR A 134 10.609 6.781 -7.538 1.00 0.00 C ATOM 2106 OG1 THR A 134 9.899 5.719 -8.186 1.00 0.00 O ATOM 2107 CG2 THR A 134 11.232 6.268 -6.249 1.00 0.00 C ATOM 0 H THR A 134 7.911 6.890 -6.793 1.00 0.00 H new ATOM 0 HA THR A 134 10.203 8.743 -6.736 1.00 0.00 H new ATOM 0 HB THR A 134 11.405 7.137 -8.192 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.952 5.758 -7.936 1.00 0.00 H new ATOM 0 HG21 THR A 134 11.902 5.438 -6.474 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.796 7.070 -5.773 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.446 5.928 -5.575 1.00 0.00 H new ATOM 2115 N GLU A 135 10.043 8.889 -9.460 1.00 0.00 N ATOM 2116 CA GLU A 135 9.668 9.425 -10.763 1.00 0.00 C ATOM 2117 C GLU A 135 9.315 8.302 -11.733 1.00 0.00 C ATOM 2118 O GLU A 135 9.476 7.122 -11.419 1.00 0.00 O ATOM 2119 CB GLU A 135 10.807 10.271 -11.338 1.00 0.00 C ATOM 2120 CG GLU A 135 11.229 11.417 -10.434 1.00 0.00 C ATOM 2121 CD GLU A 135 12.013 12.485 -11.173 1.00 0.00 C ATOM 2122 OE1 GLU A 135 13.206 12.253 -11.459 1.00 0.00 O ATOM 2123 OE2 GLU A 135 11.433 13.551 -11.466 1.00 0.00 O ATOM 0 H GLU A 135 11.049 8.844 -9.296 1.00 0.00 H new ATOM 0 HA GLU A 135 8.789 10.055 -10.628 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.668 9.629 -11.523 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.498 10.675 -12.302 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.343 11.867 -9.986 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.836 11.026 -9.617 1.00 0.00 H new ATOM 2130 N ASP A 136 8.833 8.676 -12.913 1.00 0.00 N ATOM 2131 CA ASP A 136 8.457 7.701 -13.930 1.00 0.00 C ATOM 2132 C ASP A 136 9.618 7.436 -14.884 1.00 0.00 C ATOM 2133 O ASP A 136 9.944 8.270 -15.728 1.00 0.00 O ATOM 2134 CB ASP A 136 7.240 8.193 -14.714 1.00 0.00 C ATOM 2135 CG ASP A 136 7.272 9.690 -14.953 1.00 0.00 C ATOM 2136 OD1 ASP A 136 6.872 10.445 -14.042 1.00 0.00 O ATOM 2137 OD2 ASP A 136 7.695 10.107 -16.052 1.00 0.00 O ATOM 0 H ASP A 136 8.693 9.648 -13.189 1.00 0.00 H new ATOM 0 HA ASP A 136 8.203 6.768 -13.427 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.195 7.676 -15.672 1.00 0.00 H new ATOM 0 HB3 ASP A 136 6.332 7.934 -14.170 1.00 0.00 H new ATOM 2142 N SER A 137 10.240 6.269 -14.741 1.00 0.00 N ATOM 2143 CA SER A 137 11.368 5.896 -15.587 1.00 0.00 C ATOM 2144 C SER A 137 10.918 5.682 -17.029 1.00 0.00 C ATOM 2145 O SER A 137 10.006 4.902 -17.298 1.00 0.00 O ATOM 2146 CB SER A 137 12.033 4.625 -15.054 1.00 0.00 C ATOM 2147 OG SER A 137 11.231 3.485 -15.309 1.00 0.00 O ATOM 0 H SER A 137 9.982 5.567 -14.048 1.00 0.00 H new ATOM 0 HA SER A 137 12.091 6.712 -15.568 1.00 0.00 H new ATOM 0 HB2 SER A 137 13.010 4.498 -15.521 1.00 0.00 H new ATOM 0 HB3 SER A 137 12.203 4.722 -13.982 1.00 0.00 H new ATOM 0 HG SER A 137 10.550 3.707 -15.978 1.00 0.00 H new ATOM 2153 N GLY A 138 11.567 6.383 -17.954 1.00 0.00 N ATOM 2154 CA GLY A 138 11.221 6.257 -19.358 1.00 0.00 C ATOM 2155 C GLY A 138 10.023 7.105 -19.738 1.00 0.00 C ATOM 2156 O GLY A 138 9.350 7.684 -18.886 1.00 0.00 O ATOM 0 H GLY A 138 12.326 7.035 -17.756 1.00 0.00 H new ATOM 0 HA2 GLY A 138 12.076 6.548 -19.967 1.00 0.00 H new ATOM 0 HA3 GLY A 138 11.009 5.212 -19.585 1.00 0.00 H new ATOM 2160 N PRO A 139 9.743 7.186 -21.047 1.00 0.00 N ATOM 2161 CA PRO A 139 8.618 7.968 -21.569 1.00 0.00 C ATOM 2162 C PRO A 139 7.269 7.348 -21.219 1.00 0.00 C ATOM 2163 O PRO A 139 6.341 8.046 -20.812 1.00 0.00 O ATOM 2164 CB PRO A 139 8.840 7.944 -23.083 1.00 0.00 C ATOM 2165 CG PRO A 139 9.629 6.705 -23.330 1.00 0.00 C ATOM 2166 CD PRO A 139 10.502 6.521 -22.120 1.00 0.00 C ATOM 0 HA PRO A 139 8.589 8.972 -21.145 1.00 0.00 H new ATOM 0 HB2 PRO A 139 7.893 7.924 -23.622 1.00 0.00 H new ATOM 0 HB3 PRO A 139 9.379 8.830 -23.418 1.00 0.00 H new ATOM 0 HG2 PRO A 139 8.973 5.846 -23.472 1.00 0.00 H new ATOM 0 HG3 PRO A 139 10.230 6.799 -24.234 1.00 0.00 H new ATOM 0 HD2 PRO A 139 10.668 5.466 -21.901 1.00 0.00 H new ATOM 0 HD3 PRO A 139 11.483 6.975 -22.259 1.00 0.00 H new ATOM 2174 N SER A 140 7.169 6.032 -21.379 1.00 0.00 N ATOM 2175 CA SER A 140 5.932 5.319 -21.083 1.00 0.00 C ATOM 2176 C SER A 140 5.464 5.610 -19.661 1.00 0.00 C ATOM 2177 O SER A 140 5.945 5.006 -18.702 1.00 0.00 O ATOM 2178 CB SER A 140 6.130 3.813 -21.269 1.00 0.00 C ATOM 2179 OG SER A 140 4.885 3.142 -21.357 1.00 0.00 O ATOM 0 H SER A 140 7.929 5.439 -21.712 1.00 0.00 H new ATOM 0 HA SER A 140 5.166 5.666 -21.777 1.00 0.00 H new ATOM 0 HB2 SER A 140 6.711 3.628 -22.173 1.00 0.00 H new ATOM 0 HB3 SER A 140 6.704 3.413 -20.434 1.00 0.00 H new ATOM 0 HG SER A 140 5.039 2.182 -21.477 1.00 0.00 H new ATOM 2185 N SER A 141 4.523 6.539 -19.532 1.00 0.00 N ATOM 2186 CA SER A 141 3.991 6.914 -18.227 1.00 0.00 C ATOM 2187 C SER A 141 2.988 5.877 -17.731 1.00 0.00 C ATOM 2188 O SER A 141 1.799 5.950 -18.038 1.00 0.00 O ATOM 2189 CB SER A 141 3.326 8.290 -18.300 1.00 0.00 C ATOM 2190 OG SER A 141 2.481 8.507 -17.184 1.00 0.00 O ATOM 0 H SER A 141 4.113 7.047 -20.316 1.00 0.00 H new ATOM 0 HA SER A 141 4.821 6.957 -17.522 1.00 0.00 H new ATOM 0 HB2 SER A 141 4.091 9.066 -18.337 1.00 0.00 H new ATOM 0 HB3 SER A 141 2.747 8.369 -19.220 1.00 0.00 H new ATOM 0 HG SER A 141 2.069 9.394 -17.253 1.00 0.00 H new ATOM 2196 N GLY A 142 3.478 4.911 -16.959 1.00 0.00 N ATOM 2197 CA GLY A 142 2.613 3.872 -16.432 1.00 0.00 C ATOM 2198 C GLY A 142 3.355 2.577 -16.169 1.00 0.00 C ATOM 2199 O GLY A 142 2.914 1.506 -16.586 1.00 0.00 O ATOM 0 H GLY A 142 4.458 4.830 -16.690 1.00 0.00 H new ATOM 0 HA2 GLY A 142 2.156 4.220 -15.506 1.00 0.00 H new ATOM 0 HA3 GLY A 142 1.803 3.686 -17.137 1.00 0.00 H new TER 2203 GLY A 142